4-(4-ethylpiperazine-1-carbonyl)-6,6-dimethyl-2-(4-methylphenyl)-6,7-dihydroisoquinoline-3,8(2H,5H)-dione
Chemical Structure Depiction of
4-(4-ethylpiperazine-1-carbonyl)-6,6-dimethyl-2-(4-methylphenyl)-6,7-dihydroisoquinoline-3,8(2H,5H)-dione
4-(4-ethylpiperazine-1-carbonyl)-6,6-dimethyl-2-(4-methylphenyl)-6,7-dihydroisoquinoline-3,8(2H,5H)-dione
Compound characteristics
| Compound ID: | L120-1047 |
| Compound Name: | 4-(4-ethylpiperazine-1-carbonyl)-6,6-dimethyl-2-(4-methylphenyl)-6,7-dihydroisoquinoline-3,8(2H,5H)-dione |
| Molecular Weight: | 421.54 |
| Molecular Formula: | C25 H31 N3 O3 |
| Smiles: | CCN1CCN(CC1)C(C1=C2CC(C)(C)CC(C2=CN(C1=O)c1ccc(C)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1313 |
| logD: | 1.9075 |
| logSw: | -2.3054 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.38 |
| InChI Key: | HQHAEOKXRFOKEO-UHFFFAOYSA-N |