2-[1-(2-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]-3-methyl-5-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)-1,3-thiazolidin-4-one
Chemical Structure Depiction of
2-[1-(2-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]-3-methyl-5-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)-1,3-thiazolidin-4-one
2-[1-(2-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]-3-methyl-5-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 8009-8260 |
| Compound Name: | 2-[1-(2-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]-3-methyl-5-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)-1,3-thiazolidin-4-one |
| Molecular Weight: | 468.98 |
| Molecular Formula: | C22 H17 Cl N4 O2 S2 |
| Smiles: | CC1/C(=C2/N(C)C(\C(=C3/N(C)c4ccccc4S3)S2)=O)C(N(c2ccccc2[Cl])N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2085 |
| logD: | 4.2085 |
| logSw: | -4.3382 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.418 |
| InChI Key: | MTTSSSXQBPNVAH-CAFBOWOJSA-N |