S-(1H-benzimidazol-2-yl) O-(2-methylpropyl) carbonothioate
Chemical Structure Depiction of
S-(1H-benzimidazol-2-yl) O-(2-methylpropyl) carbonothioate
S-(1H-benzimidazol-2-yl) O-(2-methylpropyl) carbonothioate
Compound characteristics
| Compound ID: | 0720-0973 |
| Compound Name: | S-(1H-benzimidazol-2-yl) O-(2-methylpropyl) carbonothioate |
| Molecular Weight: | 250.32 |
| Molecular Formula: | C12 H14 N2 O2 S |
| Smiles: | CC(C)COC(=O)Sc1nc2ccccc2[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 3.1461 |
| logD: | 3.1397 |
| logSw: | -3.3095 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.721 |
| InChI Key: | HDBCFAPJQWGFGV-UHFFFAOYSA-N |