2-chloroethyl 2-{[2-(diethylamino)-2-oxoethyl]sulfanyl}-1H-benzimidazole-1-carboxylate
Chemical Structure Depiction of
2-chloroethyl 2-{[2-(diethylamino)-2-oxoethyl]sulfanyl}-1H-benzimidazole-1-carboxylate
2-chloroethyl 2-{[2-(diethylamino)-2-oxoethyl]sulfanyl}-1H-benzimidazole-1-carboxylate
Compound characteristics
| Compound ID: | 8006-4048 |
| Compound Name: | 2-chloroethyl 2-{[2-(diethylamino)-2-oxoethyl]sulfanyl}-1H-benzimidazole-1-carboxylate |
| Molecular Weight: | 369.87 |
| Molecular Formula: | C16 H20 Cl N3 O3 S |
| Smiles: | CCN(CC)C(CSc1nc2ccccc2n1C(=O)OCC[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.837 |
| logD: | 2.837 |
| logSw: | -3.0438 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 46.711 |
| InChI Key: | FVUNORCOQGXGCE-UHFFFAOYSA-N |