(3,5-dimethylphenyl){4-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-8-oxa-2-azaspiro[4.5]decan-2-yl}methanone
Chemical Structure Depiction of
(3,5-dimethylphenyl){4-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-8-oxa-2-azaspiro[4.5]decan-2-yl}methanone
(3,5-dimethylphenyl){4-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-8-oxa-2-azaspiro[4.5]decan-2-yl}methanone
Compound characteristics
| Compound ID: | SC66-0208 |
| Compound Name: | (3,5-dimethylphenyl){4-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-8-oxa-2-azaspiro[4.5]decan-2-yl}methanone |
| Molecular Weight: | 396.53 |
| Molecular Formula: | C23 H32 N4 O2 |
| Smiles: | CC(C)Cn1cnnc1C1CN(CC12CCOCC2)C(c1cc(C)cc(C)c1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8185 |
| logD: | 2.8185 |
| logSw: | -2.9293 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.305 |
| InChI Key: | QRUFYMAZDWNYLO-FQEVSTJZSA-N |