2-(1,3-benzothiazol-2-yl)-5-(4-methoxyphenyl)-4-({[(pyridin-2-yl)methyl]amino}methylidene)-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
2-(1,3-benzothiazol-2-yl)-5-(4-methoxyphenyl)-4-({[(pyridin-2-yl)methyl]amino}methylidene)-2,4-dihydro-3H-pyrazol-3-one
2-(1,3-benzothiazol-2-yl)-5-(4-methoxyphenyl)-4-({[(pyridin-2-yl)methyl]amino}methylidene)-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 4923-3287 |
| Compound Name: | 2-(1,3-benzothiazol-2-yl)-5-(4-methoxyphenyl)-4-({[(pyridin-2-yl)methyl]amino}methylidene)-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 441.51 |
| Molecular Formula: | C24 H19 N5 O2 S |
| Smiles: | COc1ccc(cc1)C1\C(=C/NCc2ccccn2)C(N(c2nc3ccccc3s2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4964 |
| logD: | 3.4897 |
| logSw: | -3.7311 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.896 |
| InChI Key: | REFYQLXNPRJQQI-UHFFFAOYSA-N |