sodium--3-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)diazenyl]-4-hydroxynaphthalene-2,7-disulfonate (2/1)
Chemical Structure Depiction of
sodium--3-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)diazenyl]-4-hydroxynaphthalene-2,7-disulfonate (2/1)
sodium--3-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)diazenyl]-4-hydroxynaphthalene-2,7-disulfonate (2/1)
Compound characteristics
| Compound ID: | 4890-0055 |
| Compound Name: | sodium--3-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)diazenyl]-4-hydroxynaphthalene-2,7-disulfonate (2/1) |
| Molecular Weight: | 562.49 |
| Molecular Formula: | C21 H16 N4 O8 S2 |
| Salt: | 2Na+ |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)/N=N/c1c(cc2cc(ccc2c1O)S([O-])(=O)=O)S([O-])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | -1.9408 |
| logD: | -1.9909 |
| logSw: | -2.2295 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 140.947 |
| InChI Key: | LNPDPQLJMCEVLI-GHVJWSGMSA-L |