5-(pyrrolidine-1-sulfonyl)-N-[(3,4,5-triethoxyphenyl)methyl]thiophene-2-carboxamide
Chemical Structure Depiction of
5-(pyrrolidine-1-sulfonyl)-N-[(3,4,5-triethoxyphenyl)methyl]thiophene-2-carboxamide
5-(pyrrolidine-1-sulfonyl)-N-[(3,4,5-triethoxyphenyl)methyl]thiophene-2-carboxamide
Compound characteristics
Compound ID: | F561-0690 |
Compound Name: | 5-(pyrrolidine-1-sulfonyl)-N-[(3,4,5-triethoxyphenyl)methyl]thiophene-2-carboxamide |
Molecular Weight: | 482.62 |
Molecular Formula: | C22 H30 N2 O6 S2 |
Smiles: | CCOc1cc(CNC(c2ccc(s2)S(N2CCCC2)(=O)=O)=O)cc(c1OCC)OCC |
Stereo: | ACHIRAL |
logP: | 3.333 |
logD: | 3.333 |
logSw: | -3.6163 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 79.464 |
InChI Key: | JVNKBHGHDUVJRW-UHFFFAOYSA-N |