1,3-dimethyl-5-nitro-6-[4-(propane-1-sulfonyl)piperazin-1-yl]-1,3-dihydro-2H-benzimidazol-2-one
Chemical Structure Depiction of
1,3-dimethyl-5-nitro-6-[4-(propane-1-sulfonyl)piperazin-1-yl]-1,3-dihydro-2H-benzimidazol-2-one
1,3-dimethyl-5-nitro-6-[4-(propane-1-sulfonyl)piperazin-1-yl]-1,3-dihydro-2H-benzimidazol-2-one
Compound characteristics
| Compound ID: | 8017-0134 |
| Compound Name: | 1,3-dimethyl-5-nitro-6-[4-(propane-1-sulfonyl)piperazin-1-yl]-1,3-dihydro-2H-benzimidazol-2-one |
| Molecular Weight: | 397.45 |
| Molecular Formula: | C16 H23 N5 O5 S |
| Smiles: | CCCS(N1CCN(CC1)c1cc2c(cc1[N+]([O-])=O)N(C)C(N2C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4988 |
| logD: | 1.4988 |
| logSw: | -2.0687 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 85.84 |
| InChI Key: | UWKUQWQIEGGGGB-UHFFFAOYSA-N |