CS-1002873
Abeprazan Impurity 3
Manufacturer: ChemScene
CAS Number: 2253969-51-4
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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
C₁₆H₁₃F₂NO₅
Molecular Weight
337.27
Synonyms
None
SMILES
O=C(OC)C1=CN(C(=O)C)C(=C1OC(=O)C)C=2C=CC(F)=CC2F
Tpsa
74.6
Logp
2.8053
H Acceptors
6
H Donors
0
Rotatable Bonds
3
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: C₁₆H₁₃F₂NO₅
Molecular Weight: 337.27
Synonyms: None
SMILES: O=C(OC)C1=CN(C(=O)C)C(=C1OC(=O)C)C=2C=CC(F)=CC2F
Tpsa: 74.6
Logp: 2.8053
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₃F₂NO₅
Molecular Weight:
337.27
Synonyms:
None
SMILES:
O=C(OC)C1=CN(C(=O)C)C(=C1OC(=O)C)C=2C=CC(F)=CC2F
Tpsa:
74.6
Logp:
2.8053
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₈H₁₆N₂O₄
Molecular Weight: 444.44
Synonyms: None
SMILES: N#CC1=CC=C(OC=2C=CC(=C(C=O)C2)C3=CC=C(OC4=CC=C(C#N)C=C4)C=C3C=O)C=C1
Tpsa: 100.18
Logp: 6.30656
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₈H₁₆N₂O₄
Molecular Weight:
444.44
Synonyms:
None
SMILES:
N#CC1=CC=C(OC=2C=CC(=C(C=O)C2)C3=CC=C(OC4=CC=C(C#N)C=C4)C=C3C=O)C=C1
Tpsa:
100.18
Logp:
6.30656
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₃₂N₄O₅S
Molecular Weight: 440.56
Synonyms: None
SMILES: CC1=C2C(=C(C)C(S(NC(NCCC[C@@H](C(OC)=O)N)=N)(=O)=O)=C1C)CC(C)(C)O2
Tpsa: 143.6
Logp: 1.40853
H Acceptors: 7
H Donors: 4
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₃₂N₄O₅S
Molecular Weight:
440.56
Synonyms:
None
SMILES:
CC1=C2C(=C(C)C(S(NC(NCCC[C@@H](C(OC)=O)N)=N)(=O)=O)=C1C)CC(C)(C)O2
Tpsa:
143.6
Logp:
1.40853
H Acceptors:
7
H Donors:
4
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₄Cl₂N₂O₂
Molecular Weight: 241.11
Synonyms: None
SMILES: [C@@H](NC(C(CCCl)Cl)=O)(C(N)=O)CC
Tpsa: 72.19
Logp: 0.6028
H Acceptors: 2
H Donors: 2
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:
C₈H₁₄Cl₂N₂O₂
Molecular Weight:
241.11
Synonyms:
None
SMILES:
[C@@H](NC(C(CCCl)Cl)=O)(C(N)=O)CC
Tpsa:
72.19
Logp:
0.6028
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
6