4-[4-(2-fluorophenyl)piperazine-1-carbonyl]-6,6-dimethyl-2-phenyl-6,7-dihydroisoquinoline-3,8(2H,5H)-dione
Chemical Structure Depiction of
4-[4-(2-fluorophenyl)piperazine-1-carbonyl]-6,6-dimethyl-2-phenyl-6,7-dihydroisoquinoline-3,8(2H,5H)-dione
4-[4-(2-fluorophenyl)piperazine-1-carbonyl]-6,6-dimethyl-2-phenyl-6,7-dihydroisoquinoline-3,8(2H,5H)-dione
Compound characteristics
| Compound ID: | L120-1243 |
| Compound Name: | 4-[4-(2-fluorophenyl)piperazine-1-carbonyl]-6,6-dimethyl-2-phenyl-6,7-dihydroisoquinoline-3,8(2H,5H)-dione |
| Molecular Weight: | 473.55 |
| Molecular Formula: | C28 H28 F N3 O3 |
| Smiles: | CC1(C)CC2C(=CN(C(C=2C(N2CCN(CC2)c2ccccc2F)=O)=O)c2ccccc2)C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2374 |
| logD: | 3.2374 |
| logSw: | -3.516 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.802 |
| InChI Key: | YBJHQPCFZJTXEC-UHFFFAOYSA-N |