2-(1,3-benzothiazol-2-yl)-4-({[(oxolan-2-yl)methyl]amino}methylidene)-5-propyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
2-(1,3-benzothiazol-2-yl)-4-({[(oxolan-2-yl)methyl]amino}methylidene)-5-propyl-2,4-dihydro-3H-pyrazol-3-one
2-(1,3-benzothiazol-2-yl)-4-({[(oxolan-2-yl)methyl]amino}methylidene)-5-propyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | Y500-5214 |
| Compound Name: | 2-(1,3-benzothiazol-2-yl)-4-({[(oxolan-2-yl)methyl]amino}methylidene)-5-propyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 370.47 |
| Molecular Formula: | C19 H22 N4 O2 S |
| Smiles: | CCCC1\C(=C/NCC2CCCO2)C(N(c2nc3ccccc3s2)N=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9818 |
| logD: | 2.9485 |
| logSw: | -3.2054 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.639 |
| InChI Key: | FEXWYGALBSAPMZ-CYBMUJFWSA-N |