2-({acetyl[(4-fluorophenyl)methyl]amino}methyl)-4-chlorophenyl 4-acetamidobenzene-1-sulfonate
Chemical Structure Depiction of
2-({acetyl[(4-fluorophenyl)methyl]amino}methyl)-4-chlorophenyl 4-acetamidobenzene-1-sulfonate
2-({acetyl[(4-fluorophenyl)methyl]amino}methyl)-4-chlorophenyl 4-acetamidobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-3618 |
| Compound Name: | 2-({acetyl[(4-fluorophenyl)methyl]amino}methyl)-4-chlorophenyl 4-acetamidobenzene-1-sulfonate |
| Molecular Weight: | 504.96 |
| Molecular Formula: | C24 H22 Cl F N2 O5 S |
| Smiles: | CC(Nc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1CN(Cc1ccc(cc1)F)C(C)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7444 |
| logD: | 3.7442 |
| logSw: | -4.1968 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.027 |
| InChI Key: | LTKZAWKTJLXGRT-UHFFFAOYSA-N |