rel-(8aR,11aS)-N-[(4-fluorophenyl)methyl]-8-oxododecahydro-1H-cyclopenta[b][1,5]diazecine-1-carboxamide
Chemical Structure Depiction of
rel-(8aR,11aS)-N-[(4-fluorophenyl)methyl]-8-oxododecahydro-1H-cyclopenta[b][1,5]diazecine-1-carboxamide
rel-(8aR,11aS)-N-[(4-fluorophenyl)methyl]-8-oxododecahydro-1H-cyclopenta[b][1,5]diazecine-1-carboxamide
Compound characteristics
| Compound ID: | S788-0222 |
| Compound Name: | rel-(8aR,11aS)-N-[(4-fluorophenyl)methyl]-8-oxododecahydro-1H-cyclopenta[b][1,5]diazecine-1-carboxamide |
| Molecular Weight: | 347.43 |
| Molecular Formula: | C19 H26 F N3 O2 |
| Smiles: | C1CCNC([C@@H]2CCC[C@@H]2N(CC1)C(NCc1ccc(cc1)F)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.8446 |
| logD: | 1.8446 |
| logSw: | -2.4335 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.017 |
| InChI Key: | KAPIQJQGVMUPAK-SJORKVTESA-N |