5-[(N-cyclopropyl-3-fluorobenzamido)methyl]-2-methoxyphenyl propane-2-sulfonate
Chemical Structure Depiction of
5-[(N-cyclopropyl-3-fluorobenzamido)methyl]-2-methoxyphenyl propane-2-sulfonate
5-[(N-cyclopropyl-3-fluorobenzamido)methyl]-2-methoxyphenyl propane-2-sulfonate
Compound characteristics
| Compound ID: | V026-8979 |
| Compound Name: | 5-[(N-cyclopropyl-3-fluorobenzamido)methyl]-2-methoxyphenyl propane-2-sulfonate |
| Molecular Weight: | 421.49 |
| Molecular Formula: | C21 H24 F N O5 S |
| Smiles: | CC(C)S(=O)(=O)Oc1cc(CN(C2CC2)C(c2cccc(c2)F)=O)ccc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.4572 |
| logD: | 3.4572 |
| logSw: | -3.8117 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.504 |
| InChI Key: | JNMQFBUIVJYFQK-UHFFFAOYSA-N |