rel-(5aR,9aR)-8-[1-(4-methoxyphenyl)cyclohexane-1-carbonyl]-1,4-dimethyloctahydro-1H-pyrido[3,4-e][1,4]diazepine-2,5-dione
Chemical Structure Depiction of
rel-(5aR,9aR)-8-[1-(4-methoxyphenyl)cyclohexane-1-carbonyl]-1,4-dimethyloctahydro-1H-pyrido[3,4-e][1,4]diazepine-2,5-dione
rel-(5aR,9aR)-8-[1-(4-methoxyphenyl)cyclohexane-1-carbonyl]-1,4-dimethyloctahydro-1H-pyrido[3,4-e][1,4]diazepine-2,5-dione
Compound characteristics
| Compound ID: | SD15-0483 |
| Compound Name: | rel-(5aR,9aR)-8-[1-(4-methoxyphenyl)cyclohexane-1-carbonyl]-1,4-dimethyloctahydro-1H-pyrido[3,4-e][1,4]diazepine-2,5-dione |
| Molecular Weight: | 427.54 |
| Molecular Formula: | C24 H33 N3 O4 |
| Smiles: | CN1CC(N(C)[C@@H]2CN(CC[C@@H]2C1=O)C(C1(CCCCC1)c1ccc(cc1)OC)=O)=O |
| Stereo: | RELATIVE |
| logP: | 1.6743 |
| logD: | 1.6743 |
| logSw: | -2.7134 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.733 |
| InChI Key: | IGCRKTPUQUDHGJ-UXHICEINSA-N |