2-{[acetyl(cyclopropylmethyl)amino]methyl}-4-chlorophenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
2-{[acetyl(cyclopropylmethyl)amino]methyl}-4-chlorophenyl 4-fluorobenzene-1-sulfonate
2-{[acetyl(cyclopropylmethyl)amino]methyl}-4-chlorophenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V030-3318 |
| Compound Name: | 2-{[acetyl(cyclopropylmethyl)amino]methyl}-4-chlorophenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 411.88 |
| Molecular Formula: | C19 H19 Cl F N O4 S |
| Smiles: | CC(N(CC1CC1)Cc1cc(ccc1OS(c1ccc(cc1)F)(=O)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.0898 |
| logD: | 4.0898 |
| logSw: | -4.4432 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.289 |
| InChI Key: | VXEGXPLLDKOOEW-UHFFFAOYSA-N |