3-(3-chloro-4-methylphenyl)-6-{3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-1,2,4-triazin-5(2H)-one
Chemical Structure Depiction of
3-(3-chloro-4-methylphenyl)-6-{3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-1,2,4-triazin-5(2H)-one
3-(3-chloro-4-methylphenyl)-6-{3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-1,2,4-triazin-5(2H)-one
Compound characteristics
| Compound ID: | V019-2816 |
| Compound Name: | 3-(3-chloro-4-methylphenyl)-6-{3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-1,2,4-triazin-5(2H)-one |
| Molecular Weight: | 455.92 |
| Molecular Formula: | C23 H23 Cl F N5 O2 |
| Smiles: | Cc1ccc(cc1[Cl])C1NN=C(CCC(N2CCN(CC2)c2ccc(cc2)F)=O)C(N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4179 |
| logD: | 3.4179 |
| logSw: | -3.8737 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.961 |
| InChI Key: | FMTFAPBKBOWGBB-UHFFFAOYSA-N |