rel-(4R,5S)-2-benzoyl-7-methyl-N-[(thiophen-2-yl)methyl]-2,7-diazaspiro[4.4]nonane-4-carboxamide
Chemical Structure Depiction of
rel-(4R,5S)-2-benzoyl-7-methyl-N-[(thiophen-2-yl)methyl]-2,7-diazaspiro[4.4]nonane-4-carboxamide
rel-(4R,5S)-2-benzoyl-7-methyl-N-[(thiophen-2-yl)methyl]-2,7-diazaspiro[4.4]nonane-4-carboxamide
Compound characteristics
| Compound ID: | SC80-0548 |
| Compound Name: | rel-(4R,5S)-2-benzoyl-7-methyl-N-[(thiophen-2-yl)methyl]-2,7-diazaspiro[4.4]nonane-4-carboxamide |
| Molecular Weight: | 383.51 |
| Molecular Formula: | C21 H25 N3 O2 S |
| Smiles: | CN1CC[C@@]2(C1)CN(C[C@H]2C(NCc1cccs1)=O)C(c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.5227 |
| logD: | -2.9765 |
| logSw: | -2.3599 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.248 |
| InChI Key: | CFLPTTGPRZIZKB-NQIIRXRSSA-N |