2-(1,3-benzothiazol-2-yl)-5-methyl-4-[(naphthalen-1-yl)methyl]-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
2-(1,3-benzothiazol-2-yl)-5-methyl-4-[(naphthalen-1-yl)methyl]-2,4-dihydro-3H-pyrazol-3-one
2-(1,3-benzothiazol-2-yl)-5-methyl-4-[(naphthalen-1-yl)methyl]-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | Y020-1152 |
| Compound Name: | 2-(1,3-benzothiazol-2-yl)-5-methyl-4-[(naphthalen-1-yl)methyl]-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 371.46 |
| Molecular Formula: | C22 H17 N3 O S |
| Smiles: | CC1C(Cc2cccc3ccccc23)C(N(c2nc3ccccc3s2)N=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2099 |
| logD: | 4.5462 |
| logSw: | -5.9342 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.851 |
| InChI Key: | OFNBSFMFHMXOJD-GOSISDBHSA-N |