rel-(4R,5S)-2-benzoyl-N-[(2-chlorophenyl)methyl]-7-methyl-2,7-diazaspiro[4.4]nonane-4-carboxamide
Chemical Structure Depiction of
rel-(4R,5S)-2-benzoyl-N-[(2-chlorophenyl)methyl]-7-methyl-2,7-diazaspiro[4.4]nonane-4-carboxamide
rel-(4R,5S)-2-benzoyl-N-[(2-chlorophenyl)methyl]-7-methyl-2,7-diazaspiro[4.4]nonane-4-carboxamide
Compound characteristics
| Compound ID: | SC80-0534 |
| Compound Name: | rel-(4R,5S)-2-benzoyl-N-[(2-chlorophenyl)methyl]-7-methyl-2,7-diazaspiro[4.4]nonane-4-carboxamide |
| Molecular Weight: | 411.93 |
| Molecular Formula: | C23 H26 Cl N3 O2 |
| Smiles: | CN1CC[C@@]2(C1)CN(C[C@H]2C(NCc1ccccc1[Cl])=O)C(c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.3297 |
| logD: | -2.1695 |
| logSw: | -3.2562 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.229 |
| InChI Key: | VLVSIGQDHZZXQO-XXBNENTESA-N |