1-{[3,5-bis(trifluoromethyl)phenyl]methyl}-4-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)pyrrolidin-2-one
Chemical Structure Depiction of
1-{[3,5-bis(trifluoromethyl)phenyl]methyl}-4-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)pyrrolidin-2-one
1-{[3,5-bis(trifluoromethyl)phenyl]methyl}-4-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)pyrrolidin-2-one
Compound characteristics
| Compound ID: | V028-8340 |
| Compound Name: | 1-{[3,5-bis(trifluoromethyl)phenyl]methyl}-4-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)pyrrolidin-2-one |
| Molecular Weight: | 480.41 |
| Molecular Formula: | C21 H22 F6 N2 O4 |
| Smiles: | C1C(CN(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)C1=O)C(N1CCC2(CC1)OCCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0638 |
| logD: | 2.0638 |
| logSw: | -2.4097 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.519 |
| InChI Key: | YAKHFTVKZFVLTA-CQSZACIVSA-N |