2-{[4-(3,4-dimethylbenzene-1-sulfonyl)piperazin-1-yl]methyl}-1-methyl-N-(propan-2-yl)-1H-benzimidazole-5-carboxamide
Chemical Structure Depiction of
2-{[4-(3,4-dimethylbenzene-1-sulfonyl)piperazin-1-yl]methyl}-1-methyl-N-(propan-2-yl)-1H-benzimidazole-5-carboxamide
2-{[4-(3,4-dimethylbenzene-1-sulfonyl)piperazin-1-yl]methyl}-1-methyl-N-(propan-2-yl)-1H-benzimidazole-5-carboxamide
Compound characteristics
Compound ID: | L276-0225 |
Compound Name: | 2-{[4-(3,4-dimethylbenzene-1-sulfonyl)piperazin-1-yl]methyl}-1-methyl-N-(propan-2-yl)-1H-benzimidazole-5-carboxamide |
Molecular Weight: | 483.63 |
Molecular Formula: | C25 H33 N5 O3 S |
Smiles: | CC(C)NC(c1ccc2c(c1)nc(CN1CCN(CC1)S(c1ccc(C)c(C)c1)(=O)=O)n2C)=O |
Stereo: | ACHIRAL |
logP: | 3.1104 |
logD: | 3.0646 |
logSw: | -3.412 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.135 |
InChI Key: | LLFWRRKIKINRTO-UHFFFAOYSA-N |