N-(2-{4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-3-fluoro-N-(2-methylbutyl)benzamide
Chemical Structure Depiction of
N-(2-{4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-3-fluoro-N-(2-methylbutyl)benzamide
N-(2-{4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-3-fluoro-N-(2-methylbutyl)benzamide
Compound characteristics
| Compound ID: | V002-3065 |
| Compound Name: | N-(2-{4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-3-fluoro-N-(2-methylbutyl)benzamide |
| Molecular Weight: | 522.68 |
| Molecular Formula: | C30 H35 F N2 O3 S |
| Smiles: | CCC(C)CN(CC(N1CCc2c(ccs2)C1COc1ccc(C)cc1C)=O)C(c1cccc(c1)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 7.0453 |
| logD: | 7.0453 |
| logSw: | -5.7087 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.373 |
| InChI Key: | DKIQUONUULXORP-UHFFFAOYSA-N |