N-{2-[4-(4-acetylphenyl)piperazin-1-yl]-2-oxoethyl}-N-methyl-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine-7-sulfonamide
Chemical Structure Depiction of
N-{2-[4-(4-acetylphenyl)piperazin-1-yl]-2-oxoethyl}-N-methyl-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine-7-sulfonamide
N-{2-[4-(4-acetylphenyl)piperazin-1-yl]-2-oxoethyl}-N-methyl-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine-7-sulfonamide
Compound characteristics
| Compound ID: | K906-3907 |
| Compound Name: | N-{2-[4-(4-acetylphenyl)piperazin-1-yl]-2-oxoethyl}-N-methyl-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine-7-sulfonamide |
| Molecular Weight: | 513.57 |
| Molecular Formula: | C24 H27 N5 O6 S |
| Smiles: | CC(c1ccc(cc1)N1CCN(CC1)C(CN(C)S(c1ccc2c(c1)C(NCC(N2)=O)=O)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7308 |
| logD: | 0.1976 |
| logSw: | -2.6193 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 116.446 |
| InChI Key: | MGJGWDKDPAHSHL-UHFFFAOYSA-N |