4-chloro-2-[(3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]phenyl 4-methylbenzene-1-sulfonate
Chemical Structure Depiction of
4-chloro-2-[(3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]phenyl 4-methylbenzene-1-sulfonate
4-chloro-2-[(3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]phenyl 4-methylbenzene-1-sulfonate
Compound characteristics
| Compound ID: | 4157-0548 |
| Compound Name: | 4-chloro-2-[(3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]phenyl 4-methylbenzene-1-sulfonate |
| Molecular Weight: | 482.96 |
| Molecular Formula: | C23 H15 Cl N2 O4 S2 |
| Smiles: | Cc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1/C=C1/C(n2c3ccccc3nc2S1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.5831 |
| logD: | 5.5831 |
| logSw: | -5.887 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 60.301 |
| InChI Key: | JLPOLOMGBSWMRE-UHFFFAOYSA-N |