methyl [(1-{2-oxo-2-[(propan-2-yl)amino]ethyl}-1H-benzimidazol-2-yl)sulfanyl]acetate
Chemical Structure Depiction of
methyl [(1-{2-oxo-2-[(propan-2-yl)amino]ethyl}-1H-benzimidazol-2-yl)sulfanyl]acetate
methyl [(1-{2-oxo-2-[(propan-2-yl)amino]ethyl}-1H-benzimidazol-2-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | F235-0232 |
| Compound Name: | methyl [(1-{2-oxo-2-[(propan-2-yl)amino]ethyl}-1H-benzimidazol-2-yl)sulfanyl]acetate |
| Molecular Weight: | 321.4 |
| Molecular Formula: | C15 H19 N3 O3 S |
| Smiles: | CC(C)NC(Cn1c2ccccc2nc1SCC(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0654 |
| logD: | 2.0008 |
| logSw: | -2.4652 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.045 |
| InChI Key: | PFJMLMGZAKORQE-UHFFFAOYSA-N |