6,8-dibromo-3-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6,8-dibromo-3-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-2H-1-benzopyran-2-one
6,8-dibromo-3-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | K277-0030 |
| Compound Name: | 6,8-dibromo-3-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 491.2 |
| Molecular Formula: | C20 H13 Br2 N O2 S |
| Smiles: | CCc1ccc(cc1)c1csc(C2=Cc3cc(cc(c3OC2=O)[Br])[Br])n1 |
| Stereo: | ACHIRAL |
| logP: | 7.4468 |
| logD: | 7.4468 |
| logSw: | -5.6795 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 30.3067 |
| InChI Key: | NBHYSBFSZSWNAQ-UHFFFAOYSA-N |