methyl 4-chloro-2-{[4-(1-methyl-1H-benzimidazol-2-yl)piperazine-1-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-chloro-2-{[4-(1-methyl-1H-benzimidazol-2-yl)piperazine-1-carbonyl]amino}benzoate
methyl 4-chloro-2-{[4-(1-methyl-1H-benzimidazol-2-yl)piperazine-1-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | L053-0142 |
| Compound Name: | methyl 4-chloro-2-{[4-(1-methyl-1H-benzimidazol-2-yl)piperazine-1-carbonyl]amino}benzoate |
| Molecular Weight: | 427.89 |
| Molecular Formula: | C21 H22 Cl N5 O3 |
| Smiles: | [H]c1cc2c(cc1[H])n(C)c(n2)N1CCN(CC1)C(Nc1cc(ccc1C(=O)OC)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.8428 |
| logD: | 3.5109 |
| logSw: | -4.299 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.995 |
| InChI Key: | GFMODEITSBUTQA-UHFFFAOYSA-N |