4-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)benzene-1-sulfonamide
Chemical Structure Depiction of
4-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)benzene-1-sulfonamide
4-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)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | V020-9356 |
| Compound Name: | 4-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)benzene-1-sulfonamide |
| Molecular Weight: | 545.12 |
| Molecular Formula: | C27 H29 Cl N2 O4 S2 |
| Smiles: | Cc1ccc(c(C)c1)OCC1c2ccsc2CCN1C(CN(CC=C)S(c1ccc(cc1)[Cl])(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.6064 |
| logD: | 6.6064 |
| logSw: | -6.2622 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.516 |
| InChI Key: | RDJGFRNNAJCBGT-DEOSSOPVSA-N |