4-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-2-[(4-methylphenyl)methanesulfonyl]-8-oxa-2-azaspiro[4.5]decane
Chemical Structure Depiction of
4-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-2-[(4-methylphenyl)methanesulfonyl]-8-oxa-2-azaspiro[4.5]decane
4-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-2-[(4-methylphenyl)methanesulfonyl]-8-oxa-2-azaspiro[4.5]decane
Compound characteristics
| Compound ID: | SC66-0846 |
| Compound Name: | 4-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-2-[(4-methylphenyl)methanesulfonyl]-8-oxa-2-azaspiro[4.5]decane |
| Molecular Weight: | 430.57 |
| Molecular Formula: | C22 H30 N4 O3 S |
| Smiles: | Cc1ccc(CS(N2CC(c3nncn3CC3CC3)C3(CCOCC3)C2)(=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.96 |
| logD: | 1.96 |
| logSw: | -2.3795 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.513 |
| InChI Key: | VIKBUBGHAXAYAL-FQEVSTJZSA-N |