N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-4-(4-methoxyphenyl)oxane-4-carboxamide
Chemical Structure Depiction of
N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-4-(4-methoxyphenyl)oxane-4-carboxamide
N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-4-(4-methoxyphenyl)oxane-4-carboxamide
Compound characteristics
| Compound ID: | Y042-6763 |
| Compound Name: | N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-4-(4-methoxyphenyl)oxane-4-carboxamide |
| Molecular Weight: | 439.58 |
| Molecular Formula: | C24 H29 N3 O3 S |
| Smiles: | COc1ccc(cc1)C1(CCOCC1)C(N[C@@H](CCSC)c1nc2ccccc2[nH]1)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.8063 |
| logD: | 3.806 |
| logSw: | -4.1538 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.946 |
| InChI Key: | LDBSYSGGCYGWEH-NRFANRHFSA-N |