N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-bromo-4-[(3-methylphenyl)methyl]-4H-thieno[3,2-b]pyrrole-5-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-bromo-4-[(3-methylphenyl)methyl]-4H-thieno[3,2-b]pyrrole-5-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-bromo-4-[(3-methylphenyl)methyl]-4H-thieno[3,2-b]pyrrole-5-carboxamide
Compound characteristics
| Compound ID: | V002-8818 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-bromo-4-[(3-methylphenyl)methyl]-4H-thieno[3,2-b]pyrrole-5-carboxamide |
| Molecular Weight: | 483.38 |
| Molecular Formula: | C23 H19 Br N2 O3 S |
| Smiles: | Cc1cccc(Cn2c(cc3c2cc(s3)[Br])C(NCc2ccc3c(c2)OCO3)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.0362 |
| logD: | 6.0362 |
| logSw: | -5.4605 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.24 |
| InChI Key: | GQFPKMXNDSCTDT-UHFFFAOYSA-N |