CS-0615953
1-((2R,3R)-3-(4-(4-cyanophenyl)thiazol-2-yl)-2-(2,5-difluorophenyl)-2-hydroxybutyl)-4-(1-(1-((methyl(3-(((methylglycyl)oxy)methyl)pyridin-2-yl)carbamoyl)oxy)ethoxy)ethyl)-1H-1,2,4-triazol-4-ium chloride hydrochloride Isavuconazole BAL31264 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
C₃₇H₄₀Cl₂F₂N₈O₆S
Molecular Weight
833.73
Synonyms
None
SMILES
CC([N+]1=CN(C[C@@](O)([C@H](C2=NC(C3=CC=C(C#N)C=C3)=CS2)C)C4=CC(F)=CC=C4F)N=C1)OC(C)OC(N(C)C5=NC=CC=C5COC(CNC)=O)=O.[Cl-].Cl
Tpsa
168.6
Logp
1.95118
H Acceptors
13
H Donors
2
Rotatable Bonds
15
Other Options
...
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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: C₃₇H₄₀Cl₂F₂N₈O₆S
Molecular Weight: 833.73
Synonyms: None
SMILES: CC([N+]1=CN(C[C@@](O)([C@H](C2=NC(C3=CC=C(C#N)C=C3)=CS2)C)C4=CC(F)=CC=C4F)N=C1)OC(C)OC(N(C)C5=NC=CC=C5COC(CNC)=O)=O.[Cl-].Cl
Tpsa: 168.6
Logp: 1.95118
H Acceptors: 13
H Donors: 2
Rotatable Bonds: 15
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:
C₃₇H₄₀Cl₂F₂N₈O₆S
Molecular Weight:
833.73
Synonyms:
None
SMILES:
CC([N+]1=CN(C[C@@](O)([C@H](C2=NC(C3=CC=C(C#N)C=C3)=CS2)C)C4=CC(F)=CC=C4F)N=C1)OC(C)OC(N(C)C5=NC=CC=C5COC(CNC)=O)=O.[Cl-].Cl
Tpsa:
168.6
Logp:
1.95118
H Acceptors:
13
H Donors:
2
Rotatable Bonds:
15
Purity: 98%
MDL No: None
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₈ClNO
Molecular Weight: 181.62
Synonyms: None
SMILES: O=C1CC(N)C2=C1C=CC(Cl)=C2
Tpsa: 43.09
Logp: 1.9262
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₈ClNO
Molecular Weight:
181.62
Synonyms:
None
SMILES:
O=C1CC(N)C2=C1C=CC(Cl)=C2
Tpsa:
43.09
Logp:
1.9262
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
0
Purity: 97%
MDL No: None
Storage: 4°C, stored under nitrogen
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₀O₂
Molecular Weight: 150.17
Synonyms: None
SMILES: OC1=CC=C2CCOCC2=C1
Tpsa: 29.46
Logp: 1.4649
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 0
Purity:
97%
MDL No:
None
Storage:
4°C, stored under nitrogen
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₀O₂
Molecular Weight:
150.17
Synonyms:
None
SMILES:
OC1=CC=C2CCOCC2=C1
Tpsa:
29.46
Logp:
1.4649
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₄H₄FIN₂
Molecular Weight: 225.99
Synonyms: None
SMILES: CN1N=C(F)C(I)=C1
Tpsa: 17.82
Logp: 1.1638
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄H₄FIN₂
Molecular Weight:
225.99
Synonyms:
None
SMILES:
CN1N=C(F)C(I)=C1
Tpsa:
17.82
Logp:
1.1638
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
0