4-{[(4-chlorophenyl)-N-cyclopropylcarbamamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
4-{[(4-chlorophenyl)-N-cyclopropylcarbamamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
4-{[(4-chlorophenyl)-N-cyclopropylcarbamamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V012-2114 |
| Compound Name: | 4-{[(4-chlorophenyl)-N-cyclopropylcarbamamido]methyl}phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 474.94 |
| Molecular Formula: | C23 H20 Cl F N2 O4 S |
| Smiles: | C1CC1N(Cc1ccc(cc1)OS(c1ccc(cc1)F)(=O)=O)C(Nc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.2592 |
| logD: | 5.2592 |
| logSw: | -5.8511 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.336 |
| InChI Key: | KDXNVJJUQAXTCZ-UHFFFAOYSA-N |