2-(4-chlorophenyl)-4-(4-cyclohexylpiperazine-1-carbonyl)-6,6-dimethyl-6,7-dihydroisoquinoline-3,8(2H,5H)-dione
Chemical Structure Depiction of
2-(4-chlorophenyl)-4-(4-cyclohexylpiperazine-1-carbonyl)-6,6-dimethyl-6,7-dihydroisoquinoline-3,8(2H,5H)-dione
2-(4-chlorophenyl)-4-(4-cyclohexylpiperazine-1-carbonyl)-6,6-dimethyl-6,7-dihydroisoquinoline-3,8(2H,5H)-dione
Compound characteristics
| Compound ID: | L120-1544 |
| Compound Name: | 2-(4-chlorophenyl)-4-(4-cyclohexylpiperazine-1-carbonyl)-6,6-dimethyl-6,7-dihydroisoquinoline-3,8(2H,5H)-dione |
| Molecular Weight: | 496.05 |
| Molecular Formula: | C28 H34 Cl N3 O3 |
| Smiles: | CC1(C)CC2C(=CN(C(C=2C(N2CCN(CC2)C2CCCCC2)=O)=O)c2ccc(cc2)[Cl])C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.797 |
| logD: | 3.5899 |
| logSw: | -4.2892 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.936 |
| InChI Key: | DNGNKMBDTDKBQP-UHFFFAOYSA-N |