Cefatrizine Propylene Glycolate
(6R,7R)-7-[[(2R)-2-amino-2-(4-hydroxyphenyl)acetyl]amino]-8-oxo-3-(2H-triazol-4-ylsulfanylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid;propane-1,2-diol
Also Known As: Orotric|Seapuron|SEAPURO|Propyleneglycol-cefatrizine|Cefatrizine propylene glycolate|Seapuron (TN)|CEFATRIZINE PROPYLENE GLYCOL|Cefatrizine-propyleneglycol|Cefatrizine compd with propylene glycol|Cefatrizine 1,2-propanediol|EINECS 260-642-4|Cefatrizine propylene glycol CRS|51627-14-6, Cefatrizine|CEFATRIZINE PROPYLENEGLYCOLATE|1,3-BIS(4-HYDROXYBUTYL)UREA|CEFATRIZINE PROPYLENE GLYCOL [MART.]|Propylene glycolate cefatrizine (JP17)|CEFATRIZINE PROPYLENEGLYCOLATE [WHO-DD]|CEFATRIZINE PROPYLENE GLYCOL (MART.)|CEFATRIZINE PROPYLENE GLYCOL [EP IMPURITY]|CEFATRIZINE PROPYLENE GLYCOLATE [JAN]|CEFATRIZINE PROPYLENE GLYCOL [EP MONOGRAPH]|CEFATRIZINE COMPD WITH PROPYLENE GLYCOL [MI]|CEFATRIZINE PROPYLENE GLYCOL (EP IMPURITY)|CEFATRIZINE PROPYLENE GLYCOL (EP MONOGRAPH)|BRD-M47937986-001-01-7
| Molecular Formula | C21H26N6O7S2 |
|---|---|
| Molecular Weight | 538.13043 g/mol |
| LogP | -0.5995 |
| Topological Polar Surface Area | 214.99 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 8 |
| Exact Mass | 538.13043 |
| Monoisotopic Mass | 538.13043 |
| Heavy Atoms | 36 |
| Complexity | 1110.4688 |
Chemical Identifiers
| CAS Number | 64217-85-2 |
|---|---|
| SMILES | CC(CO)O.C1C(=C(N2[C@H](S1)[C@@H](C2=O)NC(=O)[C@@H](C3=CC=C(C=C3)O)N)C(=O)O)CSC4=NNN=C4 |
Product Overview
Cefatrizine Propylene Glycolate (CAS 64217-85-2), with molecular formula C21H26N6O7S2 and molecular weight 538.13043 g/mol. IUPAC: (6R,7R)-7-[[(2R)-2-amino-2-(4-hydroxyphenyl)acetyl]amino]-8-oxo-3-(2H-triazol-4-ylsulfanylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid;propane-1,2-diol.