N-(2-chloro-4-methylphenyl)-4-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-8-oxa-2-azaspiro[4.5]decane-2-carboxamide
Chemical Structure Depiction of
N-(2-chloro-4-methylphenyl)-4-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-8-oxa-2-azaspiro[4.5]decane-2-carboxamide
N-(2-chloro-4-methylphenyl)-4-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-8-oxa-2-azaspiro[4.5]decane-2-carboxamide
Compound characteristics
| Compound ID: | SC66-0302 |
| Compound Name: | N-(2-chloro-4-methylphenyl)-4-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-8-oxa-2-azaspiro[4.5]decane-2-carboxamide |
| Molecular Weight: | 431.96 |
| Molecular Formula: | C22 H30 Cl N5 O2 |
| Smiles: | CC(C)Cn1cnnc1C1CN(CC12CCOCC2)C(Nc1ccc(C)cc1[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5519 |
| logD: | 3.5519 |
| logSw: | -3.7158 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.428 |
| InChI Key: | RQZBNLUTRPCHHJ-KRWDZBQOSA-N |