{4-[(5-cyclopropyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}[1-(4-methoxyphenyl)cyclopropyl]methanone
Chemical Structure Depiction of
{4-[(5-cyclopropyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}[1-(4-methoxyphenyl)cyclopropyl]methanone
{4-[(5-cyclopropyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}[1-(4-methoxyphenyl)cyclopropyl]methanone
Compound characteristics
| Compound ID: | S564-0593 |
| Compound Name: | {4-[(5-cyclopropyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}[1-(4-methoxyphenyl)cyclopropyl]methanone |
| Molecular Weight: | 380.49 |
| Molecular Formula: | C22 H28 N4 O2 |
| Smiles: | COc1ccc(cc1)C1(CC1)C(N1CCC(CC1)Cc1nnc(C2CC2)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9514 |
| logD: | 2.9479 |
| logSw: | -3.2305 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.709 |
| InChI Key: | DIRYXGGOWDGTTF-UHFFFAOYSA-N |