CS-0532653
2-(2-(2-(2-Acetylhydrazinyl)-2-oxoacetamido)propan-2-yl)-N-(4-fluorobenzyl)-5-hydroxy-1-methyl-6-oxo-1,6-dihydropyrimidine-4-carboxamide Raltegravir Impurity
Manufacturer: ChemScene
CAS Number: 1391918-17-4
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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
C₂₀H₂₃FN₆O₆
Molecular Weight
462.43
Synonyms
None
SMILES
O=C(C(NC(C)(C)C1=NC(C(NCC2=CC=C(C=C2)F)=O)=C(C(N1C)=O)O)=O)NNC(C)=O
Tpsa
171.52
Logp
-0.9264
H Acceptors
8
H Donors
5
Rotatable Bonds
5
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1391918-17-4 | 2-Des(5-methyl-1,3,4-oxadiazole-2-carboxamide) 2-(2-(2-Acetylhydrazinyl)-2-oxoacetamide) Raltegravir | A2B Chem | -- |
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SAFETY INFORMATION
Pictograms
Signal Word
Danger
UN Number
3077
Class
9
Packing Group
Ⅲ
Hazard Statements
Precautionary Statements
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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: C₂₀H₂₃FN₆O₆
Molecular Weight: 462.43
Synonyms: None
SMILES: O=C(C(NC(C)(C)C1=NC(C(NCC2=CC=C(C=C2)F)=O)=C(C(N1C)=O)O)=O)NNC(C)=O
Tpsa: 171.52
Logp: -0.9264
H Acceptors: 8
H Donors: 5
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₂₃FN₆O₆
Molecular Weight:
462.43
Synonyms:
None
SMILES:
O=C(C(NC(C)(C)C1=NC(C(NCC2=CC=C(C=C2)F)=O)=C(C(N1C)=O)O)=O)NNC(C)=O
Tpsa:
171.52
Logp:
-0.9264
H Acceptors:
8
H Donors:
5
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₉F₃N₂O₂
Molecular Weight: 270.21
Synonyms: 3-Methyl-N-(4-(trifluoromethyl)phenyl)isoxazole-4-carboxamide
SMILES: O=C(C1=CON=C1C)NC2=CC=C(C(F)(F)F)C=C2
Tpsa: 55.13
Logp: 3.25412
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₉F₃N₂O₂
Molecular Weight:
270.21
Synonyms:
3-Methyl-N-(4-(trifluoromethyl)phenyl)isoxazole-4-carboxamide
SMILES:
O=C(C1=CON=C1C)NC2=CC=C(C(F)(F)F)C=C2
Tpsa:
55.13
Logp:
3.25412
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₁₉FN₄O₆
Molecular Weight: 406.37
Synonyms: {[2-(4-{[(4-Fluorophenyl)methyl]carbamoyl}-5-hydroxy-1-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)propan-2-yl]carbamoyl}formic acid
SMILES: O=C(C(NC(C)(C)C1=NC(C(NCC2=CC=C(C=C2)F)=O)=C(C(N1C)=O)O)=O)O
Tpsa: 150.62
Logp: -0.0091
H Acceptors: 7
H Donors: 4
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₁₉FN₄O₆
Molecular Weight:
406.37
Synonyms:
{[2-(4-{[(4-Fluorophenyl)methyl]carbamoyl}-5-hydroxy-1-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)propan-2-yl]carbamoyl}formic acid
SMILES:
O=C(C(NC(C)(C)C1=NC(C(NCC2=CC=C(C=C2)F)=O)=C(C(N1C)=O)O)=O)O
Tpsa:
150.62
Logp:
-0.0091
H Acceptors:
7
H Donors:
4
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₉F₃N₂O₂
Molecular Weight: 270.21
Synonyms: 5-Methyl-N-(2-(trifluoromethyl)phenyl)isoxazole-4-carboxamide
SMILES: O=C(C1=C(C)ON=C1)NC2=C(C(F)(F)F)C=CC=C2
Tpsa: 55.13
Logp: 3.25412
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₉F₃N₂O₂
Molecular Weight:
270.21
Synonyms:
5-Methyl-N-(2-(trifluoromethyl)phenyl)isoxazole-4-carboxamide
SMILES:
O=C(C1=C(C)ON=C1)NC2=C(C(F)(F)F)C=CC=C2
Tpsa:
55.13
Logp:
3.25412
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2