{2-bromo-4-[(7,8-dimethyl-3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]-6-ethoxyphenoxy}acetic acid
Chemical Structure Depiction of
{2-bromo-4-[(7,8-dimethyl-3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]-6-ethoxyphenoxy}acetic acid
{2-bromo-4-[(7,8-dimethyl-3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]-6-ethoxyphenoxy}acetic acid
Compound characteristics
| Compound ID: | 8010-8731 |
| Compound Name: | {2-bromo-4-[(7,8-dimethyl-3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]-6-ethoxyphenoxy}acetic acid |
| Molecular Weight: | 503.37 |
| Molecular Formula: | C22 H19 Br N2 O5 S |
| Smiles: | CCOc1cc(/C=C2/C(n3c4ccc(C)c(C)c4nc3S2)=O)cc(c1OCC(O)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.7 |
| logD: | 0.4631 |
| logSw: | -4.4369 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.49 |
| InChI Key: | VBSUMWZMVDRHIV-UHFFFAOYSA-N |