N-tert-butyl-N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-tert-butyl-N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-4-methylbenzene-1-sulfonamide
N-tert-butyl-N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-4-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | V023-7155 |
| Compound Name: | N-tert-butyl-N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-4-methylbenzene-1-sulfonamide |
| Molecular Weight: | 561.16 |
| Molecular Formula: | C28 H33 Cl N2 O4 S2 |
| Smiles: | Cc1ccc(cc1)S(N(CC(N1CCc2c(ccs2)C1COc1ccc(c(C)c1)[Cl])=O)C(C)(C)C)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.724 |
| logD: | 6.724 |
| logSw: | -6.4222 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.596 |
| InChI Key: | DLLVFFTXAZQDOQ-VWLOTQADSA-N |