N-(1-ethyl-2-{[4-(methanesulfonyl)piperazin-1-yl]methyl}-1H-benzimidazol-5-yl)-3-methylbutanamide
Chemical Structure Depiction of
N-(1-ethyl-2-{[4-(methanesulfonyl)piperazin-1-yl]methyl}-1H-benzimidazol-5-yl)-3-methylbutanamide
N-(1-ethyl-2-{[4-(methanesulfonyl)piperazin-1-yl]methyl}-1H-benzimidazol-5-yl)-3-methylbutanamide
Compound characteristics
| Compound ID: | D305-1019 |
| Compound Name: | N-(1-ethyl-2-{[4-(methanesulfonyl)piperazin-1-yl]methyl}-1H-benzimidazol-5-yl)-3-methylbutanamide |
| Molecular Weight: | 421.56 |
| Molecular Formula: | C20 H31 N5 O3 S |
| Smiles: | CCn1c2ccc(cc2nc1CN1CCN(CC1)S(C)(=O)=O)NC(CC(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.108 |
| logD: | 2.0591 |
| logSw: | -3.0617 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.304 |
| InChI Key: | AQGOHXVMZITHOG-UHFFFAOYSA-N |