2-methylpropyl 2-{[2-(diethylamino)-2-oxoethyl]sulfanyl}-1H-benzimidazole-1-carboxylate
Chemical Structure Depiction of
2-methylpropyl 2-{[2-(diethylamino)-2-oxoethyl]sulfanyl}-1H-benzimidazole-1-carboxylate
2-methylpropyl 2-{[2-(diethylamino)-2-oxoethyl]sulfanyl}-1H-benzimidazole-1-carboxylate
Compound characteristics
| Compound ID: | 8009-8070 |
| Compound Name: | 2-methylpropyl 2-{[2-(diethylamino)-2-oxoethyl]sulfanyl}-1H-benzimidazole-1-carboxylate |
| Molecular Weight: | 363.48 |
| Molecular Formula: | C18 H25 N3 O3 S |
| Smiles: | CCN(CC)C(CSc1nc2ccccc2n1C(=O)OCC(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.738 |
| logD: | 3.738 |
| logSw: | -3.8689 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 46.792 |
| InChI Key: | XDHMYBVLFBLFFV-UHFFFAOYSA-N |