methyl 4-{2-[(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetamido}benzoate
Chemical Structure Depiction of
methyl 4-{2-[(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetamido}benzoate
methyl 4-{2-[(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetamido}benzoate
Compound characteristics
| Compound ID: | 5236-0125 |
| Compound Name: | methyl 4-{2-[(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetamido}benzoate |
| Molecular Weight: | 371.41 |
| Molecular Formula: | C18 H17 N3 O4 S |
| Smiles: | COC(c1ccc(cc1)NC(CSc1nc2cc(ccc2[nH]1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9869 |
| logD: | 2.9862 |
| logSw: | -3.6118 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.847 |
| InChI Key: | RHHPKFJJSZUSNN-UHFFFAOYSA-N |