methyl 3-[(7-hydroxy-5-oxo-4,5-dihydrothieno[3,2-b]pyridine-6-carbonyl)amino]benzoate
Chemical Structure Depiction of
methyl 3-[(7-hydroxy-5-oxo-4,5-dihydrothieno[3,2-b]pyridine-6-carbonyl)amino]benzoate
methyl 3-[(7-hydroxy-5-oxo-4,5-dihydrothieno[3,2-b]pyridine-6-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | P163-0150 |
| Compound Name: | methyl 3-[(7-hydroxy-5-oxo-4,5-dihydrothieno[3,2-b]pyridine-6-carbonyl)amino]benzoate |
| Molecular Weight: | 344.34 |
| Molecular Formula: | C16 H12 N2 O5 S |
| Smiles: | COC(c1cccc(c1)NC(C1=C(c2c(ccs2)NC1=O)O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1156 |
| logD: | -4.4672 |
| logSw: | -2.9719 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.471 |
| InChI Key: | XROVXVCMQGVEQP-UHFFFAOYSA-N |