8-methyl-3-(1-phenylethyl)-5-{[3-(trifluoromethyl)phenyl]methyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
8-methyl-3-(1-phenylethyl)-5-{[3-(trifluoromethyl)phenyl]methyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
8-methyl-3-(1-phenylethyl)-5-{[3-(trifluoromethyl)phenyl]methyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | F400-0635 |
| Compound Name: | 8-methyl-3-(1-phenylethyl)-5-{[3-(trifluoromethyl)phenyl]methyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 461.49 |
| Molecular Formula: | C27 H22 F3 N3 O |
| Smiles: | CC(c1ccccc1)N1C=Nc2c3cc(C)ccc3n(Cc3cccc(c3)C(F)(F)F)c2C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.2596 |
| logD: | 6.2596 |
| logSw: | -5.7355 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.4349 |
| InChI Key: | RGVYHQWDPBERNC-SFHVURJKSA-N |