2-[(2-chlorophenyl)methanesulfonyl]-4-(4-ethyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonane
Chemical Structure Depiction of
2-[(2-chlorophenyl)methanesulfonyl]-4-(4-ethyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonane
2-[(2-chlorophenyl)methanesulfonyl]-4-(4-ethyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonane
Compound characteristics
| Compound ID: | SC69-0703 |
| Compound Name: | 2-[(2-chlorophenyl)methanesulfonyl]-4-(4-ethyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonane |
| Molecular Weight: | 408.95 |
| Molecular Formula: | C19 H25 Cl N4 O2 S |
| Smiles: | CCn1cnnc1C1CN(CC12CCCC2)S(Cc1ccccc1[Cl])(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4352 |
| logD: | 2.4351 |
| logSw: | -3.0069 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.444 |
| InChI Key: | KBUHYEDXBNGEDR-INIZCTEOSA-N |