ethyl 4-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-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-hydroxy-3-methoxyphenyl)-1,5,6,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate
ethyl 4-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-1,5,6,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate
Compound characteristics
Compound ID: | 6540-0102 |
Compound Name: | ethyl 4-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-1,5,6,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate |
Molecular Weight: | 403.46 |
Molecular Formula: | C19 H21 N3 O5 S |
Smiles: | CCOC(N1CCc2c3C(=NC(c4ccc(c(c4)OC)O)Nc3sc2C1)O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.3245 |
logD: | 2.2366 |
logSw: | -2.7173 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 82.501 |
InChI Key: | SBHPKIJIXKGGTM-MRXNPFEDSA-N |