2-(1,3-benzothiazol-2-yl)-4-({[(4-methoxyphenyl)methyl]imino}methyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
2-(1,3-benzothiazol-2-yl)-4-({[(4-methoxyphenyl)methyl]imino}methyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one
2-(1,3-benzothiazol-2-yl)-4-({[(4-methoxyphenyl)methyl]imino}methyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 5236-0054 |
| Compound Name: | 2-(1,3-benzothiazol-2-yl)-4-({[(4-methoxyphenyl)methyl]imino}methyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 440.52 |
| Molecular Formula: | C25 H20 N4 O2 S |
| Smiles: | COc1ccc(C/N=C/C2C(c3ccccc3)=NN(C2=O)c2nc3ccccc3s2)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0037 |
| logD: | 2.7466 |
| logSw: | -4.7508 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.155 |
| InChI Key: | NJWWYXQNTHHZJM-RHKYMZEHSA-N |