Cefoselis supplier | CasNO.122841-10-5

Name
Cefoselis
EINECS 1533716-785-6
CAS No. 122841-10-5
Density 1.83±0.1 g/cm3(Predicted)
Solubility
Melting Point
Formula C₁₉H₂₂N₈O₆S₂
Boiling Point
Molecular Weight 522.566
Flash Point
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylicacid,7-[[(2-amino-4-thiazolyl)(methoxyimino)acetyl]amino]-3-[[2,3-dihydro-2-(2-hydroxyethyl)-3-imino-1H-pyrazol-1-yl]methyl]-8-oxo-,[6R-[6a,7b(Z)]]-;5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylicacid,7-[[(2Z)-(2-amino-4-thiazolyl)(methoxyimino)acetyl]amino]-3-[[2,3-dihydro-2-(2-hydroxyethyl)-3-imino-1H-pyrazol-1-yl]methyl]-8-oxo-,(6R,7R)- (9CI);(-)-5-Amino-2-[[(6R,7R)-7-[2-(2-amino-4-thiazolyl)glyoxylamido]-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl]-1-(2-hydroxyethyl)pyrazoliumhydroxide, inner salt, 72-(Z)-(O-methyloxime);Wincef;
PSA 341.62000
LogP -0.24530

Cefoselis Chemical Properties

IUPAC Name: (6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-3-[[2-(2-hydroxyethyl)-3-iminopyrazol-1-yl]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Systematic of Cefoselis (CAS NO.122841-10-5): Cefoselis [INN] ; (-)-5-Amino-2-(((6R,7R)-7-(2-(2-amino-4-thiazolyl)glyoxylamido)-2-carboxy-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-en-3-yl)methyl)-1-(2-hydroxyethyl)pyrazolium hydroxide, inner salt, 7(sup 2)-(Z)-
(O-methyloxime) ; Cefoselis ; UNII-0B50MLU3H1
CAS NO: 122841-10-5
Molecular Formula of Cefoselis (CAS NO.122841-10-5): C₁₉H₂₂N₈O₆S₂
Molecular Weight: 522.558
Molecular Structure:

H bond acceptors: 14
H bond donors: 7
Freely Rotating Bonds: 11
Polar Surface Area of Cefoselis (CAS NO.122841-10-5): 258.64 Å²
SMILES: O=C2N1/C(=C(\CS[C@@H]1[C@@H]2NC(=O)C(=N\OC)\c3nc(sc3)N)C[n+]4ccc(N)n4CCO)C([O-])=O
InChI: InChI=1/C19H22N8O6S2/c1-33-24-12(10-8-35-19(21)22-10)15(29)23-13-16(30)27-14(18(31)32)9(7-34-17(13)27)6-25-3-2-11(20)26(25)4-5-28/h2-3,8,13,17,20,28H,4-7H2,1H3,(H4,21,22,23,29,31,32)/b24-12+/t13-,17-/m1/s1
InChIKey: BHXLLRXDAYEMPP-AKZFGVKSBD
Std. InChI: InChI=1S/C19H22N8O6S2/c1-33-24-12(10-8-35-19(21)22-10)15(29)23-13-16(30)27-14(18(31)32)9(7-34-17(13)27)6-25-3-2-11(20)26(25)4-5-28/h2-3,8,13,17,20,28H,4-7H2,1H3,(H4,21,22,23,29,31,32)/b24-12+/t13-,17-/m1/s1
Std. InChIKey: BHXLLRXDAYEMPP-AKZFGVKSSA-N

Product Name

Cefoselis

Cefoselis Chemical Properties

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