3-{[(propan-2-yl)(thiophene-2-carbonyl)amino]methyl}phenyl 4-acetamidobenzene-1-sulfonate
Chemical Structure Depiction of
3-{[(propan-2-yl)(thiophene-2-carbonyl)amino]methyl}phenyl 4-acetamidobenzene-1-sulfonate
3-{[(propan-2-yl)(thiophene-2-carbonyl)amino]methyl}phenyl 4-acetamidobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V024-4236 |
| Compound Name: | 3-{[(propan-2-yl)(thiophene-2-carbonyl)amino]methyl}phenyl 4-acetamidobenzene-1-sulfonate |
| Molecular Weight: | 472.58 |
| Molecular Formula: | C23 H24 N2 O5 S2 |
| Smiles: | CC(C)N(Cc1cccc(c1)OS(c1ccc(cc1)NC(C)=O)(=O)=O)C(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7424 |
| logD: | 3.7423 |
| logSw: | -3.972 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.235 |
| InChI Key: | FRKAHALGXQCBIX-UHFFFAOYSA-N |