3-[2-(6-bromo-2-imino-2H-1-benzopyran-3-yl)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[2-(6-bromo-2-imino-2H-1-benzopyran-3-yl)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one
3-[2-(6-bromo-2-imino-2H-1-benzopyran-3-yl)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 1814-2186 |
| Compound Name: | 3-[2-(6-bromo-2-imino-2H-1-benzopyran-3-yl)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 451.3 |
| Molecular Formula: | C21 H11 Br N2 O3 S |
| Smiles: | C1=C(C(=O)Oc2ccccc12)c1csc(C2=Cc3cc(ccc3OC2=N)[Br])n1 |
| Stereo: | ACHIRAL |
| logP: | 4.8207 |
| logD: | 3.4872 |
| logSw: | -5.001 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.86 |
| InChI Key: | YKAHQVXDYVTBQQ-UHFFFAOYSA-N |