N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[5-(pyrrolidine-1-sulfonyl)thiophen-2-yl]benzamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[5-(pyrrolidine-1-sulfonyl)thiophen-2-yl]benzamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[5-(pyrrolidine-1-sulfonyl)thiophen-2-yl]benzamide
Compound characteristics
| Compound ID: | L118-0087 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[5-(pyrrolidine-1-sulfonyl)thiophen-2-yl]benzamide |
| Molecular Weight: | 470.57 |
| Molecular Formula: | C23 H22 N2 O5 S2 |
| Smiles: | C1CCN(C1)S(c1ccc(c2ccc(cc2)C(NCc2ccc3c(c2)OCO3)=O)s1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0183 |
| logD: | 4.0183 |
| logSw: | -4.1268 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.591 |
| InChI Key: | YXYVJPKQGCOSSF-UHFFFAOYSA-N |