11-(4-fluorophenyl)-7,9-dimethyl-6-(thiophen-2-yl)-6H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]benzoxazine-8,10(7H,9H)-dione
Chemical Structure Depiction of
11-(4-fluorophenyl)-7,9-dimethyl-6-(thiophen-2-yl)-6H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]benzoxazine-8,10(7H,9H)-dione
11-(4-fluorophenyl)-7,9-dimethyl-6-(thiophen-2-yl)-6H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]benzoxazine-8,10(7H,9H)-dione
Compound characteristics
| Compound ID: | 8019-9729 |
| Compound Name: | 11-(4-fluorophenyl)-7,9-dimethyl-6-(thiophen-2-yl)-6H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]benzoxazine-8,10(7H,9H)-dione |
| Molecular Weight: | 459.5 |
| Molecular Formula: | C25 H18 F N3 O3 S |
| Smiles: | CN1C(c2c(c3C(c4cccs4)Oc4ccccc4n3c2c2ccc(cc2)F)N(C)C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9745 |
| logD: | 4.9745 |
| logSw: | -4.8754 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.581 |
| InChI Key: | KZKQQNJWMAIBHH-QHCPKHFHSA-N |