6-bromo-2-[(4-methoxyphenyl)imino]-N-(1,3-thiazol-2-yl)-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
6-bromo-2-[(4-methoxyphenyl)imino]-N-(1,3-thiazol-2-yl)-2H-1-benzopyran-3-carboxamide
6-bromo-2-[(4-methoxyphenyl)imino]-N-(1,3-thiazol-2-yl)-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | K218-1380 |
| Compound Name: | 6-bromo-2-[(4-methoxyphenyl)imino]-N-(1,3-thiazol-2-yl)-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 456.32 |
| Molecular Formula: | C20 H14 Br N3 O3 S |
| Smiles: | COc1ccc(cc1)/N=C1/C(=Cc2cc(ccc2O1)[Br])C(Nc1nccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4152 |
| logD: | 4.3909 |
| logSw: | -4.5244 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.058 |
| InChI Key: | PITZFLQUQVVHQH-UHFFFAOYSA-N |