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1041392-69-1,MFCD16872053
Catalog No.:AA008RO3

1041392-69-1 | (N-DANSYL)BIOCYTINAMIDOETHYL METHANETHIOSULFONATE

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Technical Information
Catalog Number:
AA008RO3
Chemical Name:
(N-DANSYL)BIOCYTINAMIDOETHYL METHANETHIOSULFONATE
CAS Number:
1041392-69-1
Molecular Formula:
C31H46N6O7S4
Molecular Weight:
742.9929
MDL Number:
MFCD16872053
SMILES:
O=C(NCCCCC(C(=O)NCCSS(=O)(=O)C)NS(=O)(=O)c1cccc2c1cccc2N(C)C)CCCCC1SCC2C1NC(=O)N2
Properties
Computed Properties
 
Complexity:
1310  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
48  
Hydrogen Bond Acceptor Count:
11  
Hydrogen Bond Donor Count:
5  
Rotatable Bond Count:
19  
Undefined Atom Stereocenter Count:
4  
XLogP3:
2.4  

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Tags:1041392-69-1 Molecular Formula|1041392-69-1 MDL|1041392-69-1 SMILES|1041392-69-1 (N-DANSYL)BIOCYTINAMIDOETHYL METHANETHIOSULFONATE