2-{[(2-methylpropyl)(thiophene-2-carbonyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
2-{[(2-methylpropyl)(thiophene-2-carbonyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate
2-{[(2-methylpropyl)(thiophene-2-carbonyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V014-7990 |
| Compound Name: | 2-{[(2-methylpropyl)(thiophene-2-carbonyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 447.55 |
| Molecular Formula: | C22 H22 F N O4 S2 |
| Smiles: | CC(C)CN(Cc1ccccc1OS(c1ccc(cc1)F)(=O)=O)C(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2634 |
| logD: | 5.2634 |
| logSw: | -5.1436 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.316 |
| InChI Key: | IKYLJXQOKLNMQW-UHFFFAOYSA-N |