(1-methyl-1H-pyrrol-2-yl)(3-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)methanone
Chemical Structure Depiction of
(1-methyl-1H-pyrrol-2-yl)(3-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)methanone
(1-methyl-1H-pyrrol-2-yl)(3-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)methanone
Compound characteristics
| Compound ID: | T501-0467 |
| Compound Name: | (1-methyl-1H-pyrrol-2-yl)(3-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)methanone |
| Molecular Weight: | 315.42 |
| Molecular Formula: | C17 H25 N5 O |
| Smiles: | CC(C)n1cnnc1CC1CCCN(C1)C(c1cccn1C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2809 |
| logD: | 2.2804 |
| logSw: | -2.5306 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 45.361 |
| InChI Key: | OVFDACICXTWWHL-CQSZACIVSA-N |