methyl 4-{2-[(1H-benzimidazol-2-yl)sulfanyl]acetamido}benzoate
Chemical Structure Depiction of
methyl 4-{2-[(1H-benzimidazol-2-yl)sulfanyl]acetamido}benzoate
methyl 4-{2-[(1H-benzimidazol-2-yl)sulfanyl]acetamido}benzoate
Compound characteristics
| Compound ID: | 3448-0641 |
| Compound Name: | methyl 4-{2-[(1H-benzimidazol-2-yl)sulfanyl]acetamido}benzoate |
| Molecular Weight: | 341.39 |
| Molecular Formula: | C17 H15 N3 O3 S |
| Smiles: | COC(c1ccc(cc1)NC(CSc1nc2ccccc2[nH]1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9443 |
| logD: | 2.9437 |
| logSw: | -3.5155 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.303 |
| InChI Key: | RLVXLLNBDYAKSN-UHFFFAOYSA-N |