N-acetyl-6-bromo-2-{[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]imino}-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-acetyl-6-bromo-2-{[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]imino}-2H-1-benzopyran-3-carboxamide
N-acetyl-6-bromo-2-{[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]imino}-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 1319-0040 |
| Compound Name: | N-acetyl-6-bromo-2-{[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]imino}-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 532.41 |
| Molecular Formula: | C26 H18 Br N3 O3 S |
| Smiles: | CC(NC(C1=Cc2cc(ccc2OC/1=N/c1ccc(cc1)c1nc2ccc(C)cc2s1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1733 |
| logD: | 5.1364 |
| logSw: | -5.068 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.834 |
| InChI Key: | PIGUATZERQQXSB-UHFFFAOYSA-N |