CS-0379764
rel-((2R,4R)-2-((1H-1,2,4-Triazol-1-yl)methyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl)methyl benzoate Itraconazole Impurity
Manufacturer: ChemScene
CAS Number: 67914-84-5
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₀H₁₇Cl₂N₃O₄
Molecular Weight
434.27
Synonyms
cis-2-(2,4-Dichlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-ylmethyl benzoate
SMILES
O=C(C1=CC=CC=C1)OC[C@@H](CO2)O[C@]2(C3=C(C=C(C=C3)Cl)Cl)CN4C=NC=N4
Tpsa
75.47
Logp
3.7103
H Acceptors
7
H Donors
0
Rotatable Bonds
6
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 67914-84-5 | cis-2-(2,4-dichlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-ylmethyl benzoate | A2B Chem | -- |
SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₁₇Cl₂N₃O₄
Molecular Weight: 434.27
Synonyms: cis-2-(2,4-Dichlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-ylmethyl benzoate
SMILES: O=C(C1=CC=CC=C1)OC[C@@H](CO2)O[C@]2(C3=C(C=C(C=C3)Cl)Cl)CN4C=NC=N4
Tpsa: 75.47
Logp: 3.7103
H Acceptors: 7
H Donors: 0
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₁₇Cl₂N₃O₄
Molecular Weight:
434.27
Synonyms:
cis-2-(2,4-Dichlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-ylmethyl benzoate
SMILES:
O=C(C1=CC=CC=C1)OC[C@@H](CO2)O[C@]2(C3=C(C=C(C=C3)Cl)Cl)CN4C=NC=N4
Tpsa:
75.47
Logp:
3.7103
H Acceptors:
7
H Donors:
0
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₂₈BrNO₂
Molecular Weight: 394.35
Synonyms: Ipratropium Bromide EP Impurity F Bromide
SMILES: CC([N@@+]1([C@H]2C[C@@H](C[C@@H]1CC2)OC(C(C3=CC=CC=C3)=C)=O)C)C.[Br-]
Tpsa: 26.3
Logp: 0.7954
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₂₈BrNO₂
Molecular Weight:
394.35
Synonyms:
Ipratropium Bromide EP Impurity F Bromide
SMILES:
CC([N@@+]1([C@H]2C[C@@H](C[C@@H]1CC2)OC(C(C3=CC=CC=C3)=C)=O)C)C.[Br-]
Tpsa:
26.3
Logp:
0.7954
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
4
Purity: 98%
MDL No: MFCD09835585
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₁N₃O₃S
Molecular Weight: 289.31
Synonyms: 4-m-Tolyl-2H-pyrido(4,3-E)(1,2,4)thiadiazin-3(4H)-one 1,1-dioxide
SMILES: O=C1NS(=O)(C2=C(N1C3=CC=CC(C)=C3)C=CN=C2)=O
Tpsa: 79.37
Logp: 1.94002
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD09835585
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₁N₃O₃S
Molecular Weight:
289.31
Synonyms:
4-m-Tolyl-2H-pyrido(4,3-E)(1,2,4)thiadiazin-3(4H)-one 1,1-dioxide
SMILES:
O=C1NS(=O)(C2=C(N1C3=CC=CC(C)=C3)C=CN=C2)=O
Tpsa:
79.37
Logp:
1.94002
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: MFCD28400895
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₂₂N₄
Molecular Weight: 246.35
Synonyms: VortioxetineImpurity20DiHCl
SMILES: C1(N2CCNCC2)=C(N3CCNCC3)C=CC=C1
Tpsa: 30.54
Logp: 0.5058
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD28400895
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₂₂N₄
Molecular Weight:
246.35
Synonyms:
VortioxetineImpurity20DiHCl
SMILES:
C1(N2CCNCC2)=C(N3CCNCC3)C=CC=C1
Tpsa:
30.54
Logp:
0.5058
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
2