4-chloro-2-{[N-(cyclopropylmethyl)-2-methylpropanamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
4-chloro-2-{[N-(cyclopropylmethyl)-2-methylpropanamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
4-chloro-2-{[N-(cyclopropylmethyl)-2-methylpropanamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V027-9487 |
| Compound Name: | 4-chloro-2-{[N-(cyclopropylmethyl)-2-methylpropanamido]methyl}phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 439.93 |
| Molecular Formula: | C21 H23 Cl F N O4 S |
| Smiles: | CC(C)C(N(CC1CC1)Cc1cc(ccc1OS(c1ccc(cc1)F)(=O)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.009 |
| logD: | 5.009 |
| logSw: | -5.069 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.821 |
| InChI Key: | QYHYXWIPEVVGCD-UHFFFAOYSA-N |