(2S)-4-methyl-N-{3-[3-(propan-2-yl)-1H-1,2,4-triazol-5-yl]phenyl}-2-(1H-pyrrol-1-yl)pentanamide
Chemical Structure Depiction of
(2S)-4-methyl-N-{3-[3-(propan-2-yl)-1H-1,2,4-triazol-5-yl]phenyl}-2-(1H-pyrrol-1-yl)pentanamide
(2S)-4-methyl-N-{3-[3-(propan-2-yl)-1H-1,2,4-triazol-5-yl]phenyl}-2-(1H-pyrrol-1-yl)pentanamide
Compound characteristics
| Compound ID: | Y043-5600 |
| Compound Name: | (2S)-4-methyl-N-{3-[3-(propan-2-yl)-1H-1,2,4-triazol-5-yl]phenyl}-2-(1H-pyrrol-1-yl)pentanamide |
| Molecular Weight: | 365.48 |
| Molecular Formula: | C21 H27 N5 O |
| Smiles: | CC(C)C[C@@H](C(Nc1cccc(c1)c1nc(C(C)C)n[nH]1)=O)n1cccc1 |
| Stereo: | ABSOLUTE |
| logP: | 4.9258 |
| logD: | 4.9005 |
| logSw: | -4.5436 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.909 |
| InChI Key: | PAZYVKALZDOBNJ-SFHVURJKSA-N |