1,3-dimethyl-5-(4-methyl-3-nitrophenyl)-10-[4-(propan-2-yl)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-methyl-3-nitrophenyl)-10-[4-(propan-2-yl)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-methyl-3-nitrophenyl)-10-[4-(propan-2-yl)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: | D280-0366 |
| Compound Name: | 1,3-dimethyl-5-(4-methyl-3-nitrophenyl)-10-[4-(propan-2-yl)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: | 488.54 |
| Molecular Formula: | C27 H28 N4 O5 |
| Smiles: | CC(C)c1ccc(cc1)C1c2c3c(C(N(C)C(N3C)=O)=O)c(c3ccc(C)c(c3)[N+]([O-])=O)n2CCO1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8267 |
| logD: | 5.8267 |
| logSw: | -5.5259 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 73.461 |
| InChI Key: | RZNKQFDKJQWDAW-RUZDIDTESA-N |