1-{8-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-6-azaspiro[3.4]octan-6-yl}-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)propan-1-one
Chemical Structure Depiction of
1-{8-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-6-azaspiro[3.4]octan-6-yl}-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)propan-1-one
1-{8-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-6-azaspiro[3.4]octan-6-yl}-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)propan-1-one
Compound characteristics
| Compound ID: | SD74-0621 |
| Compound Name: | 1-{8-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-6-azaspiro[3.4]octan-6-yl}-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)propan-1-one |
| Molecular Weight: | 396.53 |
| Molecular Formula: | C22 H32 N6 O |
| Smiles: | Cc1c(CCC(N2CC(c3nncn3CC3CC3)C3(CCC3)C2)=O)c(C)n(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.9142 |
| logD: | 0.914 |
| logSw: | -0.7684 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 56.291 |
| InChI Key: | SJEPTMSRFGQKFE-IBGZPJMESA-N |