4-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-2-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)-2-azaspiro[4.4]nonane
Chemical Structure Depiction of
4-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-2-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)-2-azaspiro[4.4]nonane
4-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-2-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)-2-azaspiro[4.4]nonane
Compound characteristics
| Compound ID: | SC46-0278 |
| Compound Name: | 4-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-2-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)-2-azaspiro[4.4]nonane |
| Molecular Weight: | 404.53 |
| Molecular Formula: | C19 H28 N6 O2 S |
| Smiles: | Cc1c(c(C)n(C)n1)S(N1CC(c2nc(C3CC3)n[nH]2)C2(CCCC2)C1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2491 |
| logD: | 1.2426 |
| logSw: | -1.9391 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.345 |
| InChI Key: | QVRXYOCJVHQFQY-HNNXBMFYSA-N |