2-chloro-6-(4-hydroxyphenyl)-7,9-dimethyl-11-(4-methylphenyl)-6H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]benzoxazine-8,10(7H,9H)-dione
Chemical Structure Depiction of
2-chloro-6-(4-hydroxyphenyl)-7,9-dimethyl-11-(4-methylphenyl)-6H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]benzoxazine-8,10(7H,9H)-dione
2-chloro-6-(4-hydroxyphenyl)-7,9-dimethyl-11-(4-methylphenyl)-6H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]benzoxazine-8,10(7H,9H)-dione
Compound characteristics
| Compound ID: | D477-0410 |
| Compound Name: | 2-chloro-6-(4-hydroxyphenyl)-7,9-dimethyl-11-(4-methylphenyl)-6H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]benzoxazine-8,10(7H,9H)-dione |
| Molecular Weight: | 499.95 |
| Molecular Formula: | C28 H22 Cl N3 O4 |
| Smiles: | Cc1ccc(cc1)c1c2C(N(C)C(N(C)c2c2C(c3ccc(cc3)O)Oc3ccc(cc3n12)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7465 |
| logD: | 5.7447 |
| logSw: | -5.9549 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.18 |
| InChI Key: | LFRQZJHKBITPQT-SANMLTNESA-N |