2-(4-chlorophenyl)-1-[4-(4-ethyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.5]decan-2-yl]ethan-1-one
Chemical Structure Depiction of
2-(4-chlorophenyl)-1-[4-(4-ethyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.5]decan-2-yl]ethan-1-one
2-(4-chlorophenyl)-1-[4-(4-ethyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.5]decan-2-yl]ethan-1-one
Compound characteristics
| Compound ID: | SC68-0136 |
| Compound Name: | 2-(4-chlorophenyl)-1-[4-(4-ethyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.5]decan-2-yl]ethan-1-one |
| Molecular Weight: | 386.92 |
| Molecular Formula: | C21 H27 Cl N4 O |
| Smiles: | CCn1cnnc1C1CN(CC12CCCCC2)C(Cc1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1252 |
| logD: | 3.1247 |
| logSw: | -3.4428 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 40.594 |
| InChI Key: | KRHGMGOXLXTISS-SFHVURJKSA-N |