6-{3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-3-{3-[(propan-2-yl)oxy]phenyl}-1,2,4-triazin-5(2H)-one
Chemical Structure Depiction of
6-{3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-3-{3-[(propan-2-yl)oxy]phenyl}-1,2,4-triazin-5(2H)-one
6-{3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-3-{3-[(propan-2-yl)oxy]phenyl}-1,2,4-triazin-5(2H)-one
Compound characteristics
| Compound ID: | V025-5082 |
| Compound Name: | 6-{3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-3-{3-[(propan-2-yl)oxy]phenyl}-1,2,4-triazin-5(2H)-one |
| Molecular Weight: | 465.53 |
| Molecular Formula: | C25 H28 F N5 O3 |
| Salt: | not_available |
| Smiles: | CC(C)Oc1cccc(c1)C1NN=C(CCC(N2CCN(CC2)c2ccc(cc2)F)=O)C(N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9129 |
| logD: | 2.9129 |
| logSw: | -3.4429 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.763 |
| InChI Key: | KOHUVWWCDZMASA-UHFFFAOYSA-N |