(3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)(3-methoxyphenyl)methanone
Chemical Structure Depiction of
(3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)(3-methoxyphenyl)methanone
(3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)(3-methoxyphenyl)methanone
Compound characteristics
| Compound ID: | T501-0581 |
| Compound Name: | (3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)(3-methoxyphenyl)methanone |
| Molecular Weight: | 354.45 |
| Molecular Formula: | C20 H26 N4 O2 |
| Smiles: | COc1cccc(c1)C(N1CCCC(Cc2nncn2CC2CC2)C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2153 |
| logD: | 2.2152 |
| logSw: | -2.5813 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.948 |
| InChI Key: | LWHSIBNMQZUPTC-MRXNPFEDSA-N |