sodium--2-(1,3-benzothiazol-2-yl)-5-benzyl-4-methyl-3-oxo-3,5-dihydro-2H-pyrazolo[4,3-c]pyridin-6-olate (1/1)
Chemical Structure Depiction of
sodium--2-(1,3-benzothiazol-2-yl)-5-benzyl-4-methyl-3-oxo-3,5-dihydro-2H-pyrazolo[4,3-c]pyridin-6-olate (1/1)
sodium--2-(1,3-benzothiazol-2-yl)-5-benzyl-4-methyl-3-oxo-3,5-dihydro-2H-pyrazolo[4,3-c]pyridin-6-olate (1/1)
Compound characteristics
| Compound ID: | 8013-5863 |
| Compound Name: | sodium--2-(1,3-benzothiazol-2-yl)-5-benzyl-4-methyl-3-oxo-3,5-dihydro-2H-pyrazolo[4,3-c]pyridin-6-olate (1/1) |
| Molecular Weight: | 410.43 |
| Molecular Formula: | C21 H15 N4 O2 S |
| Salt: | Na+ |
| Smiles: | CC1=C2C(C=C(N1Cc1ccccc1)[O-])=NN(C2=O)c1nc2ccccc2s1 |
| Stereo: | ACHIRAL |
| logP: | 4.0976 |
| logD: | 3.9671 |
| logSw: | -4.1578 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.022 |
| InChI Key: | OGCYDBPMFIEZMP-UHFFFAOYSA-M |