CS-0531803
(S)-2-((2-Amino-6-oxo-3H-purin-9(6H)-yl)methoxy)ethyl 2-formamido-3-methylbutanoate Valaciclovir Impurity
Manufacturer: ChemScene
CAS Number: 847670-62-6
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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
C₁₄H₂₀N₆O₅
Molecular Weight
352.35
Synonyms
N-Formyl Valacyclovir
SMILES
O=CN[C@@H](C(C)C)C(OCCOCN1C2=C(C(N=C(N2)N)=O)N=C1)=O
Tpsa
154.22
Logp
-1.0103
H Acceptors
9
H Donors
3
Rotatable Bonds
9
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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: C₁₄H₂₀N₆O₅
Molecular Weight: 352.35
Synonyms: N-Formyl Valacyclovir
SMILES: O=CN[C@@H](C(C)C)C(OCCOCN1C2=C(C(N=C(N2)N)=O)N=C1)=O
Tpsa: 154.22
Logp: -1.0103
H Acceptors: 9
H Donors: 3
Rotatable Bonds: 9
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₂₀N₆O₅
Molecular Weight:
352.35
Synonyms:
N-Formyl Valacyclovir
SMILES:
O=CN[C@@H](C(C)C)C(OCCOCN1C2=C(C(N=C(N2)N)=O)N=C1)=O
Tpsa:
154.22
Logp:
-1.0103
H Acceptors:
9
H Donors:
3
Rotatable Bonds:
9
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₄H₄₈F₃N₃O₂S
Molecular Weight: 619.82
Synonyms: Fluphenazine dodecanoate
SMILES: O=C(CCCCCCCCCCC)OCCN1CCN(CCCN2C3=C(SC4=CC=C(C(F)(F)F)C=C42)C=CC=C3)CC1
Tpsa: 36.02
Logp: 8.7799
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 17
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₄H₄₈F₃N₃O₂S
Molecular Weight:
619.82
Synonyms:
Fluphenazine dodecanoate
SMILES:
O=C(CCCCCCCCCCC)OCCN1CCN(CCCN2C3=C(SC4=CC=C(C(F)(F)F)C=C42)C=CC=C3)CC1
Tpsa:
36.02
Logp:
8.7799
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
17
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₂₀ClNO₄
Molecular Weight: 337.80
Synonyms: None
SMILES: O=C(CNC(CC1=CC=C(C=C1)O)C)C2=CC(O)=CC(O)=C2.Cl
Tpsa: 89.79
Logp: 2.6287
H Acceptors: 5
H Donors: 4
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:
C₁₇H₂₀ClNO₄
Molecular Weight:
337.80
Synonyms:
None
SMILES:
O=C(CNC(CC1=CC=C(C=C1)O)C)C2=CC(O)=CC(O)=C2.Cl
Tpsa:
89.79
Logp:
2.6287
H Acceptors:
5
H Donors:
4
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: C₁₀H₁₀FN₅O₃
Molecular Weight: 267.22
Synonyms: 9-(2,5-Anhydro-beta-D-arabinofuranosyl)-2-fluoro-9H-purin-6-amine
SMILES: O[C@H]1[C@H]2[C@@](N3C4=NC(F)=NC(N)=C4N=C3)([H])O[C@@H]1CO2
Tpsa: 108.31
Logp: -0.7953
H Acceptors: 8
H Donors: 2
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:
C₁₀H₁₀FN₅O₃
Molecular Weight:
267.22
Synonyms:
9-(2,5-Anhydro-beta-D-arabinofuranosyl)-2-fluoro-9H-purin-6-amine
SMILES:
O[C@H]1[C@H]2[C@@](N3C4=NC(F)=NC(N)=C4N=C3)([H])O[C@@H]1CO2
Tpsa:
108.31
Logp:
-0.7953
H Acceptors:
8
H Donors:
2
Rotatable Bonds:
1