10-(4-hydroxyphenyl)-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)-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
10-(4-hydroxyphenyl)-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
10-(4-hydroxyphenyl)-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)-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: | D280-0342 |
| Compound Name: | 10-(4-hydroxyphenyl)-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione |
| Molecular Weight: | 462.46 |
| Molecular Formula: | C24 H22 N4 O6 |
| Smiles: | Cc1ccc(cc1[N+]([O-])=O)c1c2C(N(C)C(N(C)c2c2C(c3ccc(cc3)O)OCCn12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8688 |
| logD: | 3.867 |
| logSw: | -4.2431 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.078 |
| InChI Key: | LNELEMYDTLSKCV-JOCHJYFZSA-N |