1,3-dimethyl-5-(4-methylphenyl)-10-[4-(trifluoromethyl)phenyl]-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
Chemical Structure Depiction of
1,3-dimethyl-5-(4-methylphenyl)-10-[4-(trifluoromethyl)phenyl]-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
1,3-dimethyl-5-(4-methylphenyl)-10-[4-(trifluoromethyl)phenyl]-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
Compound characteristics
| Compound ID: | D359-0683 |
| Compound Name: | 1,3-dimethyl-5-(4-methylphenyl)-10-[4-(trifluoromethyl)phenyl]-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione |
| Molecular Weight: | 469.46 |
| Molecular Formula: | C25 H22 F3 N3 O3 |
| Smiles: | Cc1ccc(cc1)c1c2C(N(C)C(N(C)c2c2C(c3ccc(cc3)C(F)(F)F)OCCn12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.35 |
| logD: | 5.35 |
| logSw: | -5.5218 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.38 |
| InChI Key: | XPCANXJWBACOJM-JOCHJYFZSA-N |