2-{[3-(4-chlorophenyl)-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Chemical Structure Depiction of
2-{[3-(4-chlorophenyl)-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
2-{[3-(4-chlorophenyl)-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Compound characteristics
| Compound ID: | 5721-0099 |
| Compound Name: | 2-{[3-(4-chlorophenyl)-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one |
| Molecular Weight: | 378.84 |
| Molecular Formula: | C19 H11 Cl N4 O S |
| Smiles: | C(=C1/C(n2c3ccccc3nc2S1)=O)\c1c[nH]nc1c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.2928 |
| logD: | 4.2928 |
| logSw: | -4.7378 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.643 |
| InChI Key: | QDSMCNNWEJAZOP-UHFFFAOYSA-N |