Basic information
- Standard SMILES
COC(=O)CCCCN(c1ccc2c(c1)nc(-c1ccccc1)n2-c1ccccc1)S(=O)(=O)c1ccc(Cl)cc1- InChIKey
UBVXVVSHEUNNFN-UHFFFAOYSA-N- Molecular formula
- C31H28ClN3O4S
- Average molar mass
- 574.1 g/mol
Names & identifiers
- Preferred name
- 5-[[(4-Chlorophenyl)sulfonyl][1,2-diphenyl-1H-benzimidazol-5-yl]amino]pentanoic acid methyl ester
- IUPAC
- methyl 5-[(4-chlorophenyl)sulfonyl-(1,2-diphenylbenzimidazol-5-yl)amino]pentanoate
Names & synonyms
SCHEMBL2328977UBVXVVSHEUNNFN-UHFFFAOYSA-N5-[[(4-Chlorophenyl) sulfonyl][1,2-diphenyl-1H-benzimidazol-5-yl]amino]pentanoic acid methyl ester5-[[(4-Chlorophenyl)sulfonyl][1,2-diphenyl-1H-benzimidazol-5-yl]amino]pentanoic acid methyl ester
Database identifiers
- PubChem CID
- 67365751
Properties
Computed structural properties
- XLogP
- 6.6
- Topological polar surface area
- 89.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 11
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 910
Related reactions
4 records
Compound notes
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