N-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-oxopropyl}-2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonamide
Chemical Structure Depiction of
N-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-oxopropyl}-2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonamide
N-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-oxopropyl}-2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonamide
Compound characteristics
Compound ID: | E977-0913 |
Compound Name: | N-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-oxopropyl}-2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonamide |
Molecular Weight: | 484.62 |
Molecular Formula: | C25 H32 N4 O4 S |
Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)C(CCNS(c1ccc2c(CCCC(N2)=O)c1)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.7825 |
logD: | 2.7823 |
logSw: | -3.4675 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 86.342 |
InChI Key: | WKNRBFKBKXQWFB-UHFFFAOYSA-N |