Basic information
- Standard SMILES
CCc1nc2c(C)cc(C)nc2n1-c1ccc(CCNC(=O)NS(=O)(=O)c2ccc(-c3ccccc3)cc2)cc1- InChIKey
UBBBCBCWMHKSKB-UHFFFAOYSA-N- Molecular formula
- C31H31N5O3S
- Average molar mass
- 553.7 g/mol
Names & identifiers
- Preferred name
- 3-{4-[2-({[(4-biphenylsulfonyl)amino]carbonyl}amino)ethyl]phenyl}-2-ethyl-5,7-dimethyl-3H-imidazo[4,5-b]pyridine
- IUPAC
- 1-[2-[4-(2-ethyl-5,7-dimethylimidazo[4,5-b]pyridin-3-yl)phenyl]ethyl]-3-(4-phenylphenyl)sulfonylurea
Names & synonyms
SCHEMBL1623829UBBBCBCWMHKSKB-UHFFFAOYSA-N3-{4-[2-({[(4-biphenylsulfonyl)amino]carbonyl}amino)ethyl]phenyl}-2-ethyl-5,7-dimethyl-3H-imidazo[4,5-b]pyridine
Database identifiers
- PubChem CID
- 21875619
Properties
Computed structural properties
- XLogP
- 6.1
- Topological polar surface area
- 114 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 920
Related reactions
12 records
Compound notes
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