5-{[cyclopropyl(thiophene-2-carbonyl)amino]methyl}-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate
Chemical Structure Depiction of
5-{[cyclopropyl(thiophene-2-carbonyl)amino]methyl}-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate
5-{[cyclopropyl(thiophene-2-carbonyl)amino]methyl}-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V029-8449 |
| Compound Name: | 5-{[cyclopropyl(thiophene-2-carbonyl)amino]methyl}-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate |
| Molecular Weight: | 512.43 |
| Molecular Formula: | C22 H19 Cl2 N O5 S2 |
| Smiles: | COc1ccc(CN(C2CC2)C(c2cccs2)=O)cc1OS(c1ccc(c(c1)[Cl])[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2378 |
| logD: | 5.2378 |
| logSw: | -5.7282 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.25 |
| InChI Key: | YYJWCKRPBGCLTL-UHFFFAOYSA-N |