N-(2-{4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-2-fluoro-N-(prop-2-en-1-yl)benzamide
Chemical Structure Depiction of
N-(2-{4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-2-fluoro-N-(prop-2-en-1-yl)benzamide
N-(2-{4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-2-fluoro-N-(prop-2-en-1-yl)benzamide
Compound characteristics
| Compound ID: | V011-1849 |
| Compound Name: | N-(2-{4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-2-fluoro-N-(prop-2-en-1-yl)benzamide |
| Molecular Weight: | 492.61 |
| Molecular Formula: | C28 H29 F N2 O3 S |
| Smiles: | Cc1ccc(c(C)c1)OCC1c2ccsc2CCN1C(CN(CC=C)C(c1ccccc1F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8911 |
| logD: | 5.8911 |
| logSw: | -5.5327 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.351 |
| InChI Key: | TXVSWBQOBQHWNT-DEOSSOPVSA-N |