1-{4-[4-(4-fluorophenyl)piperazine-1-carbonyl]phenyl}-3-[(2-methylphenyl)methyl]-1,3-diazinan-2-one
Chemical Structure Depiction of
1-{4-[4-(4-fluorophenyl)piperazine-1-carbonyl]phenyl}-3-[(2-methylphenyl)methyl]-1,3-diazinan-2-one
1-{4-[4-(4-fluorophenyl)piperazine-1-carbonyl]phenyl}-3-[(2-methylphenyl)methyl]-1,3-diazinan-2-one
Compound characteristics
| Compound ID: | J076-0112 |
| Compound Name: | 1-{4-[4-(4-fluorophenyl)piperazine-1-carbonyl]phenyl}-3-[(2-methylphenyl)methyl]-1,3-diazinan-2-one |
| Molecular Weight: | 486.59 |
| Molecular Formula: | C29 H31 F N4 O2 |
| Smiles: | Cc1ccccc1CN1CCCN(C1=O)c1ccc(cc1)C(N1CCN(CC1)c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0194 |
| logD: | 5.0194 |
| logSw: | -4.5366 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 39.706 |
| InChI Key: | CDQAUIORDUETPQ-UHFFFAOYSA-N |