2-chloro-N-[(4-ethoxyphenyl)methyl]-5-(thiomorpholine-4-sulfonyl)benzamide
Chemical Structure Depiction of
2-chloro-N-[(4-ethoxyphenyl)methyl]-5-(thiomorpholine-4-sulfonyl)benzamide
2-chloro-N-[(4-ethoxyphenyl)methyl]-5-(thiomorpholine-4-sulfonyl)benzamide
Compound characteristics
Compound ID: | L586-1495 |
Compound Name: | 2-chloro-N-[(4-ethoxyphenyl)methyl]-5-(thiomorpholine-4-sulfonyl)benzamide |
Molecular Weight: | 454.99 |
Molecular Formula: | C20 H23 Cl N2 O4 S2 |
Smiles: | CCOc1ccc(CNC(c2cc(ccc2[Cl])S(N2CCSCC2)(=O)=O)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 3.8233 |
logD: | 3.8232 |
logSw: | -4.3205 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.486 |
InChI Key: | GTHHNTUJLJKUIK-UHFFFAOYSA-N |