N-(2-{4-[(4-chlorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-4-methyl-N-(prop-2-en-1-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
N-(2-{4-[(4-chlorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-4-methyl-N-(prop-2-en-1-yl)benzene-1-sulfonamide
N-(2-{4-[(4-chlorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-4-methyl-N-(prop-2-en-1-yl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | V023-4710 |
| Compound Name: | N-(2-{4-[(4-chlorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-4-methyl-N-(prop-2-en-1-yl)benzene-1-sulfonamide |
| Molecular Weight: | 531.09 |
| Molecular Formula: | C26 H27 Cl N2 O4 S2 |
| Smiles: | Cc1ccc(cc1)S(N(CC=C)CC(N1CCc2c(ccs2)C1COc1ccc(cc1)[Cl])=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7809 |
| logD: | 5.7809 |
| logSw: | -5.9632 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.429 |
| InChI Key: | NNKKXJQHHVEPOD-DEOSSOPVSA-N |