3-({2-chloro-6-methoxy-4-[(3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]phenoxy}methyl)benzoic acid
Chemical Structure Depiction of
3-({2-chloro-6-methoxy-4-[(3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]phenoxy}methyl)benzoic acid
3-({2-chloro-6-methoxy-4-[(3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]phenoxy}methyl)benzoic acid
Compound characteristics
| Compound ID: | 4096-1123 |
| Compound Name: | 3-({2-chloro-6-methoxy-4-[(3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]phenoxy}methyl)benzoic acid |
| Molecular Weight: | 492.94 |
| Molecular Formula: | C25 H17 Cl N2 O5 S |
| Smiles: | COc1cc(/C=C2/C(n3c4ccccc4nc3S2)=O)cc(c1OCc1cccc(c1)C(O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.6577 |
| logD: | 2.7602 |
| logSw: | -5.5772 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.892 |
| InChI Key: | ARGGFLYGOMIFDV-UHFFFAOYSA-N |