3-{[(propan-2-yl)(thiophene-2-carbonyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate
Chemical Structure Depiction of
3-{[(propan-2-yl)(thiophene-2-carbonyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate
3-{[(propan-2-yl)(thiophene-2-carbonyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate
Compound characteristics
| Compound ID: | V029-4106 |
| Compound Name: | 3-{[(propan-2-yl)(thiophene-2-carbonyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate |
| Molecular Weight: | 464 |
| Molecular Formula: | C22 H22 Cl N O4 S2 |
| Smiles: | CC(C)N(Cc1cccc(c1)OS(c1c(C)cccc1[Cl])(=O)=O)C(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1173 |
| logD: | 5.1173 |
| logSw: | -5.603 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.973 |
| InChI Key: | DRBLWTDWOGPVBH-UHFFFAOYSA-N |