5-{[(butan-2-yl)(thiophene-2-carbonyl)amino]methyl}-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate
Chemical Structure Depiction of
5-{[(butan-2-yl)(thiophene-2-carbonyl)amino]methyl}-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate
5-{[(butan-2-yl)(thiophene-2-carbonyl)amino]methyl}-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-4336 |
| Compound Name: | 5-{[(butan-2-yl)(thiophene-2-carbonyl)amino]methyl}-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate |
| Molecular Weight: | 528.47 |
| Molecular Formula: | C23 H23 Cl2 N O5 S2 |
| Smiles: | CCC(C)N(Cc1ccc(c(c1)OS(c1ccc(c(c1)[Cl])[Cl])(=O)=O)OC)C(c1cccs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.838 |
| logD: | 5.838 |
| logSw: | -6.0078 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.275 |
| InChI Key: | FQTLQPSGUOUPBT-HNNXBMFYSA-N |