3-(2-methylpropyl)-8-(propane-2-sulfonyl)-1-{[3-(trifluoromethyl)phenyl]methyl}-1,4,8-triazaspiro[4.5]decan-2-one
Chemical Structure Depiction of
3-(2-methylpropyl)-8-(propane-2-sulfonyl)-1-{[3-(trifluoromethyl)phenyl]methyl}-1,4,8-triazaspiro[4.5]decan-2-one
3-(2-methylpropyl)-8-(propane-2-sulfonyl)-1-{[3-(trifluoromethyl)phenyl]methyl}-1,4,8-triazaspiro[4.5]decan-2-one
Compound characteristics
| Compound ID: | V028-0671 |
| Compound Name: | 3-(2-methylpropyl)-8-(propane-2-sulfonyl)-1-{[3-(trifluoromethyl)phenyl]methyl}-1,4,8-triazaspiro[4.5]decan-2-one |
| Molecular Weight: | 475.57 |
| Molecular Formula: | C22 H32 F3 N3 O3 S |
| Smiles: | CC(C)CC1C(N(Cc2cccc(c2)C(F)(F)F)C2(CCN(CC2)S(C(C)C)(=O)=O)N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.128 |
| logD: | 4.0965 |
| logSw: | -4.2362 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.654 |
| InChI Key: | JDNBZBCXJZCBFO-IBGZPJMESA-N |