N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylbutyl]-4-phenyloxane-4-carboxamide
Chemical Structure Depiction of
N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylbutyl]-4-phenyloxane-4-carboxamide
N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylbutyl]-4-phenyloxane-4-carboxamide
Compound characteristics
| Compound ID: | Y042-7418 |
| Compound Name: | N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylbutyl]-4-phenyloxane-4-carboxamide |
| Molecular Weight: | 391.51 |
| Molecular Formula: | C24 H29 N3 O2 |
| Smiles: | CC(C)C[C@@H](c1nc2ccccc2[nH]1)NC(C1(CCOCC1)c1ccccc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 4.3576 |
| logD: | 4.3562 |
| logSw: | -4.2372 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.402 |
| InChI Key: | LOTCJOGYDGPOIN-NRFANRHFSA-N |