8-(4-methylbenzoyl)-3-(2-methylpropyl)-1-{[3-(trifluoromethyl)phenyl]methyl}-1,4,8-triazaspiro[4.5]decan-2-one
Chemical Structure Depiction of
8-(4-methylbenzoyl)-3-(2-methylpropyl)-1-{[3-(trifluoromethyl)phenyl]methyl}-1,4,8-triazaspiro[4.5]decan-2-one
8-(4-methylbenzoyl)-3-(2-methylpropyl)-1-{[3-(trifluoromethyl)phenyl]methyl}-1,4,8-triazaspiro[4.5]decan-2-one
Compound characteristics
| Compound ID: | V027-9915 |
| Compound Name: | 8-(4-methylbenzoyl)-3-(2-methylpropyl)-1-{[3-(trifluoromethyl)phenyl]methyl}-1,4,8-triazaspiro[4.5]decan-2-one |
| Molecular Weight: | 487.57 |
| Molecular Formula: | C27 H32 F3 N3 O2 |
| Smiles: | CC(C)CC1C(N(Cc2cccc(c2)C(F)(F)F)C2(CCN(CC2)C(c2ccc(C)cc2)=O)N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8388 |
| logD: | 4.5707 |
| logSw: | -4.5327 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.32 |
| InChI Key: | CIGXZDXJZZKDLB-QHCPKHFHSA-N |