4-(4-methylbenzoyl)-8-(3-nitrobenzoyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide
Chemical Structure Depiction of
4-(4-methylbenzoyl)-8-(3-nitrobenzoyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide
4-(4-methylbenzoyl)-8-(3-nitrobenzoyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide
Compound characteristics
| Compound ID: | V028-0098 |
| Compound Name: | 4-(4-methylbenzoyl)-8-(3-nitrobenzoyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide |
| Molecular Weight: | 610.59 |
| Molecular Formula: | C31 H29 F3 N4 O6 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)C(N1C(COC12CCN(CC2)C(c1cccc(c1)[N+]([O-])=O)=O)C(NCc1cccc(c1)C(F)(F)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8187 |
| logD: | 3.8187 |
| logSw: | -3.9916 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.377 |
| InChI Key: | UQGKGQLOBVDWKW-SANMLTNESA-N |