1-{8-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-6-azaspiro[3.4]octan-6-yl}-2-(3,4-dimethylphenoxy)ethan-1-one
Chemical Structure Depiction of
1-{8-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-6-azaspiro[3.4]octan-6-yl}-2-(3,4-dimethylphenoxy)ethan-1-one
1-{8-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-6-azaspiro[3.4]octan-6-yl}-2-(3,4-dimethylphenoxy)ethan-1-one
Compound characteristics
| Compound ID: | SD74-0608 |
| Compound Name: | 1-{8-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-6-azaspiro[3.4]octan-6-yl}-2-(3,4-dimethylphenoxy)ethan-1-one |
| Molecular Weight: | 394.52 |
| Molecular Formula: | C23 H30 N4 O2 |
| Smiles: | Cc1ccc(cc1C)OCC(N1CC(c2nncn2CC2CC2)C2(CCC2)C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8344 |
| logD: | 2.8344 |
| logSw: | -3.0418 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.951 |
| InChI Key: | QMZVOIXTDNGAEI-FQEVSTJZSA-N |