3-({cyclopropyl[(4-fluorophenyl)acetyl]amino}methyl)phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
3-({cyclopropyl[(4-fluorophenyl)acetyl]amino}methyl)phenyl 4-fluorobenzene-1-sulfonate
3-({cyclopropyl[(4-fluorophenyl)acetyl]amino}methyl)phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V012-0123 |
| Compound Name: | 3-({cyclopropyl[(4-fluorophenyl)acetyl]amino}methyl)phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 457.5 |
| Molecular Formula: | C24 H21 F2 N O4 S |
| Smiles: | C1CC1N(Cc1cccc(c1)OS(c1ccc(cc1)F)(=O)=O)C(Cc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6545 |
| logD: | 4.6545 |
| logSw: | -4.8308 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.988 |
| InChI Key: | QMJABEKRRNVZID-UHFFFAOYSA-N |