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78287-27-1,MFCD06657922
Catalog No.:AA003NCE

78287-27-1 | (19S)-10,19-diethyl-19-hydroxy-17-oxa-3,13-diazapentacyclo[11.8.0.0^{2,11}.0^{4,9}.0^{15,20}]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione

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Purity
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25mg
>98%(HPLC)
in stock  
$32.00   $23.00
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100mg
>96.0%(HPLC)
in stock  
$40.00   $28.00
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1g
99%
in stock  
$71.00   $50.00
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5g
99%
in stock  
$350.00   $245.00
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25g
98%
in stock  
$1,407.00   $985.00
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  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003NCE
Chemical Name:
(19S)-10,19-diethyl-19-hydroxy-17-oxa-3,13-diazapentacyclo[11.8.0.0^{2,11}.0^{4,9}.0^{15,20}]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione
CAS Number:
78287-27-1
Molecular Formula:
C22H20N2O4
Molecular Weight:
376.4052
MDL Number:
MFCD06657922
SMILES:
CC[C@@]1(O)C(=O)OCc2c1cc1c3nc4ccccc4c(c3Cn1c2=O)CC
Properties
Properties
 
BP:
752.867 °C at 760 mmHg  
Form:
Solid  
MP:
236-241°C  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
787  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
1.8  

Upstream Synthesis Route

[1]Patent:CN108484624,2018,A,.Locationinpatent:Paragraph0031;0039;0043;0044

[2]ChemicalandPharmaceuticalBulletin,1991,vol.39,#6,p.1446-1454

[3]ChemicalandPharmaceuticalBulletin,1991,vol.39,#10,p.2574-2580

[4]Patent:WO2006/16203,2006,A1,.Locationinpatent:Page/Pagecolumn9-10

[5]EuropeanJournalofPharmaceuticalSciences,2018,vol.123,p.546-559

[1]Patent:EP2011797,2009,A1,.Locationinpatent:Page/Pagecolumn10-11

[1]Patent:US4399282,1983,A,

[1]SyntheticCommunications,2007,vol.37,#3,p.519-523

[1]Patent:US4399282,1983,A,

Downstream Synthesis Route

[1]ChemicalandPharmaceuticalBulletin,1991,vol.39,p.1446-1454

[2]ChemicalandPharmaceuticalBulletin,1991,vol.39,p.3183-3188

[3]Patent:CN109796462,2019,A.Locationinpatent:Paragraph0027;0029;0034;0036;0041;0043

[1]ChemicalandPharmaceuticalBulletin,1993,vol.41,p.971-974

78287-27-1   
2-Amino-4,11-diethyl-2H,12H-2,6,12a-triaza-dibenzob,hfluorene-3,13-dione 

[1]ChemicalandPharmaceuticalBulletin,1993,vol.41,p.971-974

[1]ChemicalandPharmaceuticalBulletin,1993,vol.41,p.971-974

[1]Patent:CN108484624,2018,A.Locationinpatent:Paragraph0031;0039;0043;0044

[2]ChemicalandPharmaceuticalBulletin,1991,vol.39,p.1446-1454

[3]ChemicalandPharmaceuticalBulletin,1991,vol.39,p.2574-2580

[4]Patent:CN109796462,2019,A.Locationinpatent:Paragraph0027-0028;0034-0035;0041-0042

[5]Patent:WO2006/16203,2006,A1.Locationinpatent:Page/Pagecolumn9-10

[6]EuropeanJournalofPharmaceuticalSciences,2018,vol.123,p.546-559

Literature

Title: 14-Aminocamptothecins: their synthesis, preclinical activity, and potential use for cancer treatment.

Journal: Journal of medicinal chemistry 20110324

Title: The thermodynamic dissociation constants of the anticancer drugs camptothecine, 7-ethyl-10-hydroxycamptothecine, 10-hydroxycamptothecine and 7-ethylcamptothecine by the least-squares nonlinear regression of multiwavelength spectrophotometric pH-titration data.

Journal: Analytica chimica acta 20070219

Title: Wang, X.,et al. New Route for Conversion of Camptothecin to 7-Ethylcamptothecin and 7-Propylcamptothecin. Synthetic Communications, 2007,37(3), 519–523.

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SDS
Tags:78287-27-1 Molecular Formula|78287-27-1 MDL|78287-27-1 SMILES|78287-27-1 (19S)-10,19-diethyl-19-hydroxy-17-oxa-3,13-diazapentacyclo[11.8.0.0^{2,11}.0^{4,9}.0^{15,20}]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione