4-chloro-2-{[(propan-2-yl)(thiophene-2-carbonyl)amino]methyl}phenyl 4-acetamidobenzene-1-sulfonate
Chemical Structure Depiction of
4-chloro-2-{[(propan-2-yl)(thiophene-2-carbonyl)amino]methyl}phenyl 4-acetamidobenzene-1-sulfonate
4-chloro-2-{[(propan-2-yl)(thiophene-2-carbonyl)amino]methyl}phenyl 4-acetamidobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-3599 |
| Compound Name: | 4-chloro-2-{[(propan-2-yl)(thiophene-2-carbonyl)amino]methyl}phenyl 4-acetamidobenzene-1-sulfonate |
| Molecular Weight: | 507.03 |
| Molecular Formula: | C23 H23 Cl N2 O5 S2 |
| Smiles: | CC(C)N(Cc1cc(ccc1OS(c1ccc(cc1)NC(C)=O)(=O)=O)[Cl])C(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5513 |
| logD: | 4.5512 |
| logSw: | -4.6406 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.322 |
| InChI Key: | CIXGPFBIUFJOBO-UHFFFAOYSA-N |