3-chloro-N-(2-{4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)benzamide
Chemical Structure Depiction of
3-chloro-N-(2-{4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)benzamide
3-chloro-N-(2-{4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)benzamide
Compound characteristics
Compound ID: | V003-1513 |
Compound Name: | 3-chloro-N-(2-{4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)benzamide |
Molecular Weight: | 509.07 |
Molecular Formula: | C28 H29 Cl N2 O3 S |
Smiles: | Cc1ccc(c(C)c1)OCC1c2ccsc2CCN1C(CN(CC=C)C(c1cccc(c1)[Cl])=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 6.3342 |
logD: | 6.3342 |
logSw: | -6.1927 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 40.351 |
InChI Key: | UXHALBHZSDWMKF-DEOSSOPVSA-N |