methyl 2-{[4-(1-benzyl-1H-benzimidazol-2-yl)piperazine-1-carbonyl]amino}-4-chlorobenzoate
Chemical Structure Depiction of
methyl 2-{[4-(1-benzyl-1H-benzimidazol-2-yl)piperazine-1-carbonyl]amino}-4-chlorobenzoate
methyl 2-{[4-(1-benzyl-1H-benzimidazol-2-yl)piperazine-1-carbonyl]amino}-4-chlorobenzoate
Compound characteristics
| Compound ID: | C700-2740 |
| Compound Name: | methyl 2-{[4-(1-benzyl-1H-benzimidazol-2-yl)piperazine-1-carbonyl]amino}-4-chlorobenzoate |
| Molecular Weight: | 503.99 |
| Molecular Formula: | C27 H26 Cl N5 O3 |
| Smiles: | COC(c1ccc(cc1NC(N1CCN(CC1)c1nc2ccccc2n1Cc1ccccc1)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.6405 |
| logD: | 5.5489 |
| logSw: | -5.8798 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.913 |
| InChI Key: | QBZLXVKKVUJMEZ-UHFFFAOYSA-N |