CS-0615931

mono(1-((2R,3R)-3-(4-(4-(tert-butoxy(imino)methyl)phenyl)thiazol-2-yl)-2-(2,5-difluorophenyl)-2-hydroxybutyl)-4-(1-((methyl(3-((2-(methyl-l4-azanyl)acetoxy)methyl)pyridin-2-yl)carbamoyl)oxy)ethyl)-1H-1,2,4-triazol-4-ium) dichloride Isavuconazole BAL20027 Impurity

Manufacturer: ChemScene

CAS Number: None

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Purity

98%

MDL No

None

Storage

4°C, sealed storage, away from moisture and light

Shipping

Room temperature in continental US; may vary elsewhere.

Molecular Formula

C₃₉H₄₆Cl₂F₂N₈O₆S-

Molecular Weight

863.80

Synonyms

None

SMILES

C[NH2]CC(OCC1=CC=CN=C1N(C(OC([N+]2=CN(N=C2)C[C@](C3=CC(F)=CC=C3F)([C@H](C4=NC(C5=CC=C(C=C5)C(OC(C)(C)C)=N)=CS4)C)O)C)=O)C)=O.[Cl-].[Cl-]

Tpsa

168.66

Logp

2.85737

H Acceptors

13

H Donors

3

Rotatable Bonds

14

SAFETY INFORMATION

Pictograms

N/A

Signal Word

N/A

UN Number

N/A

Class

N/A

Packing Group

N/A

Hazard Statements

N/A

Precautionary Statements

N/A