4-chloro-2-{[N-(2-methoxyethyl)(propan-2-yl)carbamamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
4-chloro-2-{[N-(2-methoxyethyl)(propan-2-yl)carbamamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
4-chloro-2-{[N-(2-methoxyethyl)(propan-2-yl)carbamamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V024-5616 |
| Compound Name: | 4-chloro-2-{[N-(2-methoxyethyl)(propan-2-yl)carbamamido]methyl}phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 458.94 |
| Molecular Formula: | C20 H24 Cl F N2 O5 S |
| Smiles: | CC(C)NC(N(CCOC)Cc1cc(ccc1OS(c1ccc(cc1)F)(=O)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.9718 |
| logD: | 3.9718 |
| logSw: | -4.3694 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.007 |
| InChI Key: | MUSIDIOTJRJLCL-UHFFFAOYSA-N |