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Home Pyridines 10189-78-3
10189-78-3,MFCD01568823
Catalog No.:AA0005RY
10189-78-3 | 6,11-Dihydro-5h-pyrido[2,3-b][1,5]benzodiazepin-5-one
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1g
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$549.00   $384.00
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Technical Information
Catalog Number:
AA0005RY
Chemical Name:
6,11-Dihydro-5h-pyrido[2,3-b][1,5]benzodiazepin-5-one
CAS Number:
10189-78-3
Molecular Formula:
C12H9N3O
Molecular Weight:
211.2194
MDL Number:
MFCD01568823
IUPAC Name:
6,11-dihydropyrido[3,2-c][1,5]benzodiazepin-5-one
InChI:
InChI=1S/C12H9N3O/c16-12-8-4-3-7-13-11(8)14-9-5-1-2-6-10(9)15-12/h1-7H,(H,13,14)(H,15,16)
InChI Key:
SFRAVXBSPHJEBZ-UHFFFAOYSA-N
SMILES:
O=c1[nH]c2ccccc2[nH]c2c1cccn2
Properties
Computed Properties
 
Complexity:
281  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.075g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
211.224g/mol
Monoisotopic Mass:
211.075g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

Synonyms
 
10189-78-3 
6,11-Dihydro-5H-pyrido[2,3-b][1,5]benzodiazepin-5-one 
MLS000537582 
CHEMBL72135 
SCHEMBL5937366 
SCHEMBL17786321 
CTK4A0374 
DTXSID80144315 
SFRAVXBSPHJEBZ-UHFFFAOYSA-N 
HMS2189D14 
ZINC382835 
KS-000021HE 
6,11-Dihydro-5H-benzo[b]pyrido[2,3-e][1,4]diazepin-5-one 
0509AA 
MFCD01568823 
AKOS001847999 
MCULE-5100728417 
NCGC00247239-01 
AJ-20356 
SMR000161257 
AX8245235 
DB-058720 
CS-0062213 
6,11-dihydropyrido[3,2-c][1,5]benzodiazepin-5-one 
FT-0729547 
9N-757 
AO-095/42800781 
5H-Pyrido[2,3-b][1,5]benzodiazepin-5-one,6,11-dihydro- 
2,4,10-triazatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3(8),4,6,12,14-hexaen-9-one 
BI-RG-587 analog 
C12H9N3O 
AIDS003102 
CID453241 
5H-Pyrido(2,3-b)(1,5)benzodiazepin-5-one, 6,11-dihydro- 
5H-Pyrido[2,3-b][1,5]benzodiazepin-5-one, 6,11-dihydro- 
W-200654 
6,11-Dihydro-5H-pyrido(2,3-b)(1,5)benzodiazepin-5-one 
AC1L9QTW 
Oprea1_170599 
Literature

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

Title: Novel non-nucleoside inhibitors of HIV-1 reverse transcriptase. 1. Tricyclic pyridobenzo- and dipyridodiazepinones.

Journal: Journal of medicinal chemistry 19910701

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