N-(3-ethylphenyl)-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-(3-ethylphenyl)-4-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-8-oxa-2-azaspiro[4.5]decane-2-carboxamide
N-(3-ethylphenyl)-4-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-8-oxa-2-azaspiro[4.5]decane-2-carboxamide
Compound characteristics
| Compound ID: | SC66-0328 |
| Compound Name: | N-(3-ethylphenyl)-4-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-8-oxa-2-azaspiro[4.5]decane-2-carboxamide |
| Molecular Weight: | 411.55 |
| Molecular Formula: | C23 H33 N5 O2 |
| Smiles: | CCc1cccc(c1)NC(N1CC(c2nncn2CC(C)C)C2(CCOCC2)C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2225 |
| logD: | 3.2225 |
| logSw: | -3.4396 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.126 |
| InChI Key: | VGHFCXGYPIFRAA-FQEVSTJZSA-N |