(5-methylthiophen-2-yl)[(2S)-2-(5-phenyl-4H-1,2,4-triazol-3-yl)pyrrolidin-1-yl]methanone
Chemical Structure Depiction of
(5-methylthiophen-2-yl)[(2S)-2-(5-phenyl-4H-1,2,4-triazol-3-yl)pyrrolidin-1-yl]methanone
(5-methylthiophen-2-yl)[(2S)-2-(5-phenyl-4H-1,2,4-triazol-3-yl)pyrrolidin-1-yl]methanone
Compound characteristics
| Compound ID: | P930-1213 |
| Compound Name: | (5-methylthiophen-2-yl)[(2S)-2-(5-phenyl-4H-1,2,4-triazol-3-yl)pyrrolidin-1-yl]methanone |
| Molecular Weight: | 338.43 |
| Molecular Formula: | C18 H18 N4 O S |
| Smiles: | Cc1ccc(C(N2CCC[C@H]2c2nnc(c3ccccc3)[nH]2)=O)s1 |
| Stereo: | ABSOLUTE |
| logP: | 3.1824 |
| logD: | 3.1469 |
| logSw: | -3.1829 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.478 |
| InChI Key: | MOFCOQUDINFGKS-AWEZNQCLSA-N |