5-[(N-cyclopropyl-3-fluorobenzamido)methyl]-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate
Chemical Structure Depiction of
5-[(N-cyclopropyl-3-fluorobenzamido)methyl]-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate
5-[(N-cyclopropyl-3-fluorobenzamido)methyl]-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V029-8414 |
| Compound Name: | 5-[(N-cyclopropyl-3-fluorobenzamido)methyl]-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate |
| Molecular Weight: | 524.39 |
| Molecular Formula: | C24 H20 Cl2 F N O5 S |
| Smiles: | COc1ccc(CN(C2CC2)C(c2cccc(c2)F)=O)cc1OS(c1ccc(c(c1)[Cl])[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3456 |
| logD: | 5.3456 |
| logSw: | -5.9846 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.232 |
| InChI Key: | ZZTDNWBQOJSABP-UHFFFAOYSA-N |