ethyl 4-hydroxy-2-(4-methoxy-3-nitrophenyl)-1,5,6,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate
Chemical Structure Depiction of
ethyl 4-hydroxy-2-(4-methoxy-3-nitrophenyl)-1,5,6,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate
ethyl 4-hydroxy-2-(4-methoxy-3-nitrophenyl)-1,5,6,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate
Compound characteristics
| Compound ID: | 6540-0120 |
| Compound Name: | ethyl 4-hydroxy-2-(4-methoxy-3-nitrophenyl)-1,5,6,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate |
| Molecular Weight: | 432.45 |
| Molecular Formula: | C19 H20 N4 O6 S |
| Smiles: | CCOC(N1CCc2c3C(=NC(c4ccc(c(c4)[N+]([O-])=O)OC)Nc3sc2C1)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6305 |
| logD: | 2.5456 |
| logSw: | -2.9849 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.034 |
| InChI Key: | KHKNIJAPCFEGBA-MRXNPFEDSA-N |