ethyl 2-({[3-(4-chlorophenoxy)-2-hydroxypropyl](2-methylpropyl)amino}methyl)-4-oxo-5-(propan-2-yl)-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 2-({[3-(4-chlorophenoxy)-2-hydroxypropyl](2-methylpropyl)amino}methyl)-4-oxo-5-(propan-2-yl)-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
ethyl 2-({[3-(4-chlorophenoxy)-2-hydroxypropyl](2-methylpropyl)amino}methyl)-4-oxo-5-(propan-2-yl)-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V030-3119 |
| Compound Name: | ethyl 2-({[3-(4-chlorophenoxy)-2-hydroxypropyl](2-methylpropyl)amino}methyl)-4-oxo-5-(propan-2-yl)-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate |
| Molecular Weight: | 536.09 |
| Molecular Formula: | C26 H34 Cl N3 O5 S |
| Salt: | not_available |
| Smiles: | CCOC(c1c(C(C)C)c2C(NC(CN(CC(C)C)CC(COc3ccc(cc3)[Cl])O)=Nc2s1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3912 |
| logD: | 5.3901 |
| logSw: | -5.784 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.658 |
| InChI Key: | WPELDMNYQOCOPH-SFHVURJKSA-N |