1-{4-[4-(2-fluorophenyl)piperazine-1-carbonyl]phenyl}-3-[(4-methylphenyl)methyl]-1,3-diazinan-2-one
Chemical Structure Depiction of
1-{4-[4-(2-fluorophenyl)piperazine-1-carbonyl]phenyl}-3-[(4-methylphenyl)methyl]-1,3-diazinan-2-one
1-{4-[4-(2-fluorophenyl)piperazine-1-carbonyl]phenyl}-3-[(4-methylphenyl)methyl]-1,3-diazinan-2-one
Compound characteristics
| Compound ID: | J076-0213 |
| Compound Name: | 1-{4-[4-(2-fluorophenyl)piperazine-1-carbonyl]phenyl}-3-[(4-methylphenyl)methyl]-1,3-diazinan-2-one |
| Molecular Weight: | 486.59 |
| Molecular Formula: | C29 H31 F N4 O2 |
| Smiles: | Cc1ccc(CN2CCCN(C2=O)c2ccc(cc2)C(N2CCN(CC2)c2ccccc2F)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5662 |
| logD: | 4.5662 |
| logSw: | -4.2277 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 39.405 |
| InChI Key: | IOOORMVFYFGVFC-UHFFFAOYSA-N |