7-(3-bromo-4-methoxyphenyl)-3-phenyl-6,7-dihydrothieno[3,2-b]pyridin-5(4H)-one
Chemical Structure Depiction of
7-(3-bromo-4-methoxyphenyl)-3-phenyl-6,7-dihydrothieno[3,2-b]pyridin-5(4H)-one
7-(3-bromo-4-methoxyphenyl)-3-phenyl-6,7-dihydrothieno[3,2-b]pyridin-5(4H)-one
Compound characteristics
| Compound ID: | J025-0136 |
| Compound Name: | 7-(3-bromo-4-methoxyphenyl)-3-phenyl-6,7-dihydrothieno[3,2-b]pyridin-5(4H)-one |
| Molecular Weight: | 414.32 |
| Molecular Formula: | C20 H16 Br N O2 S |
| Smiles: | COc1ccc(cc1[Br])C1CC(Nc2c(csc12)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5585 |
| logD: | 4.5585 |
| logSw: | -4.4786 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 30.9128 |
| InChI Key: | DBPOQXAXASXIPM-CQSZACIVSA-N |