CS-0616085
((2R,3S,4R,5R)-3,4-Dihydroxy-5-(4-((isobutyryloxy)imino)-2-oxo-3,4-dihydropyrimidin-1(2H)-yl)tetrahydrofuran-2-yl)methyl isobutyrate Molnupiravir Impurity
Manufacturer: ChemScene
CAS Number: 2684302-84-7
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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
C₁₇H₂₅N₃O₈
Molecular Weight
399.40
Synonyms
None
SMILES
O[C@H]1[C@H](N2C(N/C(C=C2)=N/OC(C(C)C)=O)=O)O[C@@H]([C@H]1O)COC(C(C)C)=O
Tpsa
152.44
Logp
-0.9903
H Acceptors
10
H Donors
3
Rotatable Bonds
6
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 2684302-84-7 | | 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: C₁₇H₂₅N₃O₈
Molecular Weight: 399.40
Synonyms: None
SMILES: O[C@H]1[C@H](N2C(N/C(C=C2)=N/OC(C(C)C)=O)=O)O[C@@H]([C@H]1O)COC(C(C)C)=O
Tpsa: 152.44
Logp: -0.9903
H Acceptors: 10
H Donors: 3
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:
C₁₇H₂₅N₃O₈
Molecular Weight:
399.40
Synonyms:
None
SMILES:
O[C@H]1[C@H](N2C(N/C(C=C2)=N/OC(C(C)C)=O)=O)O[C@@H]([C@H]1O)COC(C(C)C)=O
Tpsa:
152.44
Logp:
-0.9903
H Acceptors:
10
H Donors:
3
Rotatable Bonds:
6
Purity: 95%
MDL No: None
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₇FN₄
Molecular Weight: 166.16
Synonyms: None
SMILES: NCC1=NN=C2C(F)=CC=CN21
Tpsa: 56.21
Logp: 0.3271
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₇FN₄
Molecular Weight:
166.16
Synonyms:
None
SMILES:
NCC1=NN=C2C(F)=CC=CN21
Tpsa:
56.21
Logp:
0.3271
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₉N₃O₇
Molecular Weight: 329.31
Synonyms: None
SMILES: O[C@H]1[C@H](N2C(N/C(C=C2)=N/OC(C(C)C)=O)=O)O[C@@H]([C@H]1O)CO
Tpsa: 146.37
Logp: -2.1972
H Acceptors: 9
H Donors: 4
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:
C₁₃H₁₉N₃O₇
Molecular Weight:
329.31
Synonyms:
None
SMILES:
O[C@H]1[C@H](N2C(N/C(C=C2)=N/OC(C(C)C)=O)=O)O[C@@H]([C@H]1O)CO
Tpsa:
146.37
Logp:
-2.1972
H Acceptors:
9
H Donors:
4
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₁F₃N₂
Molecular Weight: 204.19
Synonyms: None
SMILES: NC1=CC=C(N(C)C)C(C(F)(F)F)=C1
Tpsa: 29.26
Logp: 2.3536
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₁F₃N₂
Molecular Weight:
204.19
Synonyms:
None
SMILES:
NC1=CC=C(N(C)C)C(C(F)(F)F)=C1
Tpsa:
29.26
Logp:
2.3536
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1