methyl 3-[(4-benzyl-7-hydroxy-5-oxo-4,5-dihydrothieno[3,2-b]pyridine-6-carbonyl)amino]benzoate
Chemical Structure Depiction of
methyl 3-[(4-benzyl-7-hydroxy-5-oxo-4,5-dihydrothieno[3,2-b]pyridine-6-carbonyl)amino]benzoate
methyl 3-[(4-benzyl-7-hydroxy-5-oxo-4,5-dihydrothieno[3,2-b]pyridine-6-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | P163-0871 |
| Compound Name: | methyl 3-[(4-benzyl-7-hydroxy-5-oxo-4,5-dihydrothieno[3,2-b]pyridine-6-carbonyl)amino]benzoate |
| Molecular Weight: | 434.47 |
| Molecular Formula: | C23 H18 N2 O5 S |
| Smiles: | COC(c1cccc(c1)NC(C1=C(c2c(ccs2)N(Cc2ccccc2)C1=O)O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0454 |
| logD: | -2.4584 |
| logSw: | -4.0672 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.696 |
| InChI Key: | NDUSJCUZPMVHQG-UHFFFAOYSA-N |