N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(pyrrolidine-1-sulfonyl)thiophene-2-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(pyrrolidine-1-sulfonyl)thiophene-2-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(pyrrolidine-1-sulfonyl)thiophene-2-carboxamide
Compound characteristics
| Compound ID: | F561-0741 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(pyrrolidine-1-sulfonyl)thiophene-2-carboxamide |
| Molecular Weight: | 394.47 |
| Molecular Formula: | C17 H18 N2 O5 S2 |
| Smiles: | C1CCN(C1)S(c1ccc(C(NCc2ccc3c(c2)OCO3)=O)s1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5058 |
| logD: | 2.5058 |
| logSw: | -2.9694 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.863 |
| InChI Key: | VUKQBYWRMSDYPA-UHFFFAOYSA-N |