2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)imino]-N-(2-fluorophenyl)-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)imino]-N-(2-fluorophenyl)-2H-1-benzopyran-3-carboxamide
2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)imino]-N-(2-fluorophenyl)-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 2432-4477 |
| Compound Name: | 2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)imino]-N-(2-fluorophenyl)-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 461.51 |
| Molecular Formula: | C25 H20 F N3 O3 S |
| Smiles: | C1CCc2c(C1)c(C(N)=O)c(/N=C1/C(=Cc3ccccc3O1)C(Nc1ccccc1F)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.6524 |
| logD: | 3.6457 |
| logSw: | -4.4806 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 72.112 |
| InChI Key: | YBJPHFAUSRPFLW-UHFFFAOYSA-N |