1-(4-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)-2-phenylpropan-1-one
Chemical Structure Depiction of
1-(4-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)-2-phenylpropan-1-one
1-(4-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)-2-phenylpropan-1-one
Compound characteristics
| Compound ID: | S517-0377 |
| Compound Name: | 1-(4-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)-2-phenylpropan-1-one |
| Molecular Weight: | 352.48 |
| Molecular Formula: | C21 H28 N4 O |
| Smiles: | CC(C(N1CCC(CC1)Cc1nncn1CC1CC1)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2439 |
| logD: | 3.2436 |
| logSw: | -3.3801 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 42.471 |
| InChI Key: | KCSXSLWVHJOHMB-MRXNPFEDSA-N |