6-bromo-2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)imino]-N-phenyl-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
6-bromo-2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)imino]-N-phenyl-2H-1-benzopyran-3-carboxamide
6-bromo-2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)imino]-N-phenyl-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 2265-3125 |
| Compound Name: | 6-bromo-2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)imino]-N-phenyl-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 504.4 |
| Molecular Formula: | C25 H18 Br N3 O2 S |
| Smiles: | C1CCc2c(C1)c(C#N)c(/N=C1/C(=Cc3cc(ccc3O1)[Br])C(Nc1ccccc1)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 5.9045 |
| logD: | 5.9044 |
| logSw: | -5.923 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.807 |
| InChI Key: | FUGZLJNQCIRJTJ-UHFFFAOYSA-N |