4-(azepane-1-carbonyl)-2-(4-fluorophenyl)-6,6-dimethyl-6,7-dihydroisoquinoline-3,8(2H,5H)-dione
Chemical Structure Depiction of
4-(azepane-1-carbonyl)-2-(4-fluorophenyl)-6,6-dimethyl-6,7-dihydroisoquinoline-3,8(2H,5H)-dione
4-(azepane-1-carbonyl)-2-(4-fluorophenyl)-6,6-dimethyl-6,7-dihydroisoquinoline-3,8(2H,5H)-dione
Compound characteristics
| Compound ID: | L120-0805 |
| Compound Name: | 4-(azepane-1-carbonyl)-2-(4-fluorophenyl)-6,6-dimethyl-6,7-dihydroisoquinoline-3,8(2H,5H)-dione |
| Molecular Weight: | 410.49 |
| Molecular Formula: | C24 H27 F N2 O3 |
| Smiles: | CC1(C)CC2C(=CN(C(C=2C(N2CCCCCC2)=O)=O)c2ccc(cc2)F)C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0701 |
| logD: | 3.0701 |
| logSw: | -3.1883 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.174 |
| InChI Key: | LYHWAXBHRWOUEG-UHFFFAOYSA-N |