2-[(3-bromophenyl)imino]-6-nitro-N-(1,3-thiazol-2-yl)-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
2-[(3-bromophenyl)imino]-6-nitro-N-(1,3-thiazol-2-yl)-2H-1-benzopyran-3-carboxamide
2-[(3-bromophenyl)imino]-6-nitro-N-(1,3-thiazol-2-yl)-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | K218-1448 |
| Compound Name: | 2-[(3-bromophenyl)imino]-6-nitro-N-(1,3-thiazol-2-yl)-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 471.29 |
| Molecular Formula: | C19 H11 Br N4 O4 S |
| Smiles: | C1=C(/C(=N/c2cccc(c2)[Br])Oc2ccc(cc12)[N+]([O-])=O)C(Nc1nccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.632 |
| logD: | 4.6077 |
| logSw: | -4.9167 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.896 |
| InChI Key: | LUJKSMFLKZOXAW-UHFFFAOYSA-N |