3-bromo-N-(2-{4-[(4-chlorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(cyclopropylmethyl)benzamide
Chemical Structure Depiction of
3-bromo-N-(2-{4-[(4-chlorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(cyclopropylmethyl)benzamide
3-bromo-N-(2-{4-[(4-chlorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(cyclopropylmethyl)benzamide
Compound characteristics
| Compound ID: | V011-5013 |
| Compound Name: | 3-bromo-N-(2-{4-[(4-chlorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(cyclopropylmethyl)benzamide |
| Molecular Weight: | 573.94 |
| Molecular Formula: | C27 H26 Br Cl N2 O3 S |
| Smiles: | C1CN(C(COc2ccc(cc2)[Cl])c2ccsc12)C(CN(CC1CC1)C(c1cccc(c1)[Br])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.2403 |
| logD: | 6.2403 |
| logSw: | -6.4727 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.538 |
| InChI Key: | XLDNSRUKSKKYNZ-DEOSSOPVSA-N |