3-benzyl-2-[1-(2-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]-5-(5-methoxy-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-1,3-thiazolidin-4-one
Chemical Structure Depiction of
3-benzyl-2-[1-(2-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]-5-(5-methoxy-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-1,3-thiazolidin-4-one
3-benzyl-2-[1-(2-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]-5-(5-methoxy-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 8009-7543 |
| Compound Name: | 3-benzyl-2-[1-(2-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]-5-(5-methoxy-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-1,3-thiazolidin-4-one |
| Molecular Weight: | 575.11 |
| Molecular Formula: | C29 H23 Cl N4 O3 S2 |
| Smiles: | CC1/C(=C2/N(Cc3ccccc3)C(\C(=C3/N(C)c4cc(ccc4S3)OC)S2)=O)C(N(c2ccccc2[Cl])N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5032 |
| logD: | 6.5032 |
| logSw: | -6.0339 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.925 |
| InChI Key: | FCTSKAUHGFVOGO-UHFFFAOYSA-N |