N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-bromo-4-[(4-methoxyphenyl)methyl]-4H-thieno[3,2-b]pyrrole-5-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-bromo-4-[(4-methoxyphenyl)methyl]-4H-thieno[3,2-b]pyrrole-5-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-bromo-4-[(4-methoxyphenyl)methyl]-4H-thieno[3,2-b]pyrrole-5-carboxamide
Compound characteristics
| Compound ID: | V002-8852 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-bromo-4-[(4-methoxyphenyl)methyl]-4H-thieno[3,2-b]pyrrole-5-carboxamide |
| Molecular Weight: | 499.38 |
| Molecular Formula: | C23 H19 Br N2 O4 S |
| Smiles: | COc1ccc(Cn2c(cc3c2cc(s3)[Br])C(NCc2ccc3c(c2)OCO3)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.372 |
| logD: | 5.372 |
| logSw: | -5.4451 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.783 |
| InChI Key: | YQLNEBDJJSLHTM-UHFFFAOYSA-N |