5-[1-(3-cyclohexylpropanoyl)piperidin-4-yl]-4-cyclopentyl-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
5-[1-(3-cyclohexylpropanoyl)piperidin-4-yl]-4-cyclopentyl-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
5-[1-(3-cyclohexylpropanoyl)piperidin-4-yl]-4-cyclopentyl-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | S559-0335 |
| Compound Name: | 5-[1-(3-cyclohexylpropanoyl)piperidin-4-yl]-4-cyclopentyl-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 388.55 |
| Molecular Formula: | C22 H36 N4 O2 |
| Smiles: | CN1C(N(C2CCCC2)C(C2CCN(CC2)C(CCC2CCCCC2)=O)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9897 |
| logD: | 3.9823 |
| logSw: | -3.9776 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.997 |
| InChI Key: | ZGHZUWFBZBYRLB-UHFFFAOYSA-N |