sodium--2-(1,3-benzothiazol-2-yl)-4-methyl-5-(2-methylbutyl)-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)-4-methyl-5-(2-methylbutyl)-3-oxo-3,5-dihydro-2H-pyrazolo[4,3-c]pyridin-6-olate (1/1)
sodium--2-(1,3-benzothiazol-2-yl)-4-methyl-5-(2-methylbutyl)-3-oxo-3,5-dihydro-2H-pyrazolo[4,3-c]pyridin-6-olate (1/1)
Compound characteristics
| Compound ID: | 8015-8724 |
| Compound Name: | sodium--2-(1,3-benzothiazol-2-yl)-4-methyl-5-(2-methylbutyl)-3-oxo-3,5-dihydro-2H-pyrazolo[4,3-c]pyridin-6-olate (1/1) |
| Molecular Weight: | 390.44 |
| Molecular Formula: | C19 H19 N4 O2 S |
| Salt: | Na+ |
| Smiles: | CCC(C)CN1C(=CC2C(=C1C)C(N(c1nc3ccccc3s1)N=2)=O)[O-] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1319 |
| logD: | 4.014 |
| logSw: | -4.0574 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.294 |
| InChI Key: | GAEWOOZKUROAPV-NSHDSACASA-M |