6-(3,4-dihydroxyphenyl)-11-(4-fluorophenyl)-7,9-dimethyl-6H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]benzoxazine-8,10(7H,9H)-dione
Chemical Structure Depiction of
6-(3,4-dihydroxyphenyl)-11-(4-fluorophenyl)-7,9-dimethyl-6H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]benzoxazine-8,10(7H,9H)-dione
6-(3,4-dihydroxyphenyl)-11-(4-fluorophenyl)-7,9-dimethyl-6H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]benzoxazine-8,10(7H,9H)-dione
Compound characteristics
| Compound ID: | D477-0761 |
| Compound Name: | 6-(3,4-dihydroxyphenyl)-11-(4-fluorophenyl)-7,9-dimethyl-6H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]benzoxazine-8,10(7H,9H)-dione |
| Molecular Weight: | 485.47 |
| Molecular Formula: | C27 H20 F N3 O5 |
| Smiles: | CN1C(c2c(c3C(c4ccc(c(c4)O)O)Oc4ccccc4n3c2c2ccc(cc2)F)N(C)C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3137 |
| logD: | 4.2971 |
| logSw: | -4.3092 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.659 |
| InChI Key: | COKSGVURJQHBBL-VWLOTQADSA-N |