N-[5-(4-methyl-1,4-diazepane-1-carbonyl)-2-(piperazin-1-yl)phenyl]-4-(2-methylpropyl)benzene-1-sulfonamide
Chemical Structure Depiction of
N-[5-(4-methyl-1,4-diazepane-1-carbonyl)-2-(piperazin-1-yl)phenyl]-4-(2-methylpropyl)benzene-1-sulfonamide
N-[5-(4-methyl-1,4-diazepane-1-carbonyl)-2-(piperazin-1-yl)phenyl]-4-(2-methylpropyl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | F919-0386 |
| Compound Name: | N-[5-(4-methyl-1,4-diazepane-1-carbonyl)-2-(piperazin-1-yl)phenyl]-4-(2-methylpropyl)benzene-1-sulfonamide |
| Molecular Weight: | 627.73 |
| Molecular Formula: | C27 H39 N5 O3 S |
| Salt: | CF3COOH |
| Smiles: | CC(C)Cc1ccc(cc1)S(Nc1cc(ccc1N1CCNCC1)C(N1CCCN(C)CC1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9652 |
| logD: | 2.9652 |
| logSw: | -3.6633 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.758 |
| InChI Key: | JVPMGNFQOAUOHI-UHFFFAOYSA-N |