5-[1-(4-chloro-2-methoxybenzoyl)piperidin-4-yl]-4-cyclopentyl-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
5-[1-(4-chloro-2-methoxybenzoyl)piperidin-4-yl]-4-cyclopentyl-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
5-[1-(4-chloro-2-methoxybenzoyl)piperidin-4-yl]-4-cyclopentyl-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | S559-0384 |
| Compound Name: | 5-[1-(4-chloro-2-methoxybenzoyl)piperidin-4-yl]-4-cyclopentyl-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 418.92 |
| Molecular Formula: | C21 H27 Cl N4 O3 |
| Smiles: | CN1C(N(C2CCCC2)C(C2CCN(CC2)C(c2ccc(cc2OC)[Cl])=O)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7242 |
| logD: | 3.7168 |
| logSw: | -4.153 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.963 |
| InChI Key: | FAKFFJSNELXGJN-UHFFFAOYSA-N |