methyl 2-({N-[(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetyl]glycyl}amino)benzoate
Chemical Structure Depiction of
methyl 2-({N-[(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetyl]glycyl}amino)benzoate
methyl 2-({N-[(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetyl]glycyl}amino)benzoate
Compound characteristics
| Compound ID: | 3909-9410 |
| Compound Name: | methyl 2-({N-[(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetyl]glycyl}amino)benzoate |
| Molecular Weight: | 454.5 |
| Molecular Formula: | C22 H22 N4 O5 S |
| Smiles: | COC(c1ccccc1NC(CNC(CN1C=Nc2c(C1=O)c1CCCCc1s2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3346 |
| logD: | 2.3213 |
| logSw: | -3.0383 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.259 |
| InChI Key: | FDOYYHLTHOTMEU-UHFFFAOYSA-N |