2-[(4-chlorophenyl)methanesulfonyl]-4-(4-methyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.5]decane
Chemical Structure Depiction of
2-[(4-chlorophenyl)methanesulfonyl]-4-(4-methyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.5]decane
2-[(4-chlorophenyl)methanesulfonyl]-4-(4-methyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.5]decane
Compound characteristics
| Compound ID: | SC68-1581 |
| Compound Name: | 2-[(4-chlorophenyl)methanesulfonyl]-4-(4-methyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.5]decane |
| Molecular Weight: | 408.95 |
| Molecular Formula: | C19 H25 Cl N4 O2 S |
| Smiles: | Cn1cnnc1C1CN(CC12CCCCC2)S(Cc1ccc(cc1)[Cl])(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3597 |
| logD: | 2.3597 |
| logSw: | -2.9729 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.909 |
| InChI Key: | BWEMRDKPEFENCP-KRWDZBQOSA-N |