N-[1-(1H-benzimidazol-2-yl)-2-phenylethyl]-2-[4-(1H-pyrrol-1-yl)thian-4-yl]acetamide
Chemical Structure Depiction of
N-[1-(1H-benzimidazol-2-yl)-2-phenylethyl]-2-[4-(1H-pyrrol-1-yl)thian-4-yl]acetamide
N-[1-(1H-benzimidazol-2-yl)-2-phenylethyl]-2-[4-(1H-pyrrol-1-yl)thian-4-yl]acetamide
Compound characteristics
| Compound ID: | Y042-2323 |
| Compound Name: | N-[1-(1H-benzimidazol-2-yl)-2-phenylethyl]-2-[4-(1H-pyrrol-1-yl)thian-4-yl]acetamide |
| Molecular Weight: | 444.6 |
| Molecular Formula: | C26 H28 N4 O S |
| Smiles: | C(C(c1nc2ccccc2[nH]1)NC(CC1(CCSCC1)n1cccc1)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4082 |
| logD: | 4.4076 |
| logSw: | -4.4667 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.855 |
| InChI Key: | KBQNWNZOILHASK-QHCPKHFHSA-N |