CS-0166385
1-[(4-Methoxy-3,5-dimethyl-2-pyridinyl)methyl]-6-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl]-1H-benzimidazole (Esomeprazole Impurity）
Manufacturer: ChemScene
CAS Number: 2101206-66-8
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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
C₂₆H₃₀N₄O₄S
Molecular Weight
494.61
Synonyms
None
SMILES
O=S(C1=NC2=CC=C(OC)C=C2N1CC3=NC=C(C)C(OC)=C3C)CC4=NC=C(C)C(OC)=C4C
Tpsa
88.36
Logp
4.44188
H Acceptors
8
H Donors
0
Rotatable Bonds
8
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: C₂₆H₃₀N₄O₄S
Molecular Weight: 494.61
Synonyms: None
SMILES: O=S(C1=NC2=CC=C(OC)C=C2N1CC3=NC=C(C)C(OC)=C3C)CC4=NC=C(C)C(OC)=C4C
Tpsa: 88.36
Logp: 4.44188
H Acceptors: 8
H Donors: 0
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₆H₃₀N₄O₄S
Molecular Weight:
494.61
Synonyms:
None
SMILES:
O=S(C1=NC2=CC=C(OC)C=C2N1CC3=NC=C(C)C(OC)=C3C)CC4=NC=C(C)C(OC)=C4C
Tpsa:
88.36
Logp:
4.44188
H Acceptors:
8
H Donors:
0
Rotatable Bonds:
8
Purity: 98%
MDL No: MFCD08063743
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₂₁N₃O₄S
Molecular Weight: 375.44
Synonyms: None
SMILES: O=S(C1=NC2=C(N1)C=CC=C2)(CC3=NC=CC(OCCCOC)=C3C)=O
Tpsa: 94.17
Logp: 2.65552
H Acceptors: 6
H Donors: 1
Rotatable Bonds: 8
Purity:
98%
MDL No:
MFCD08063743
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₂₁N₃O₄S
Molecular Weight:
375.44
Synonyms:
None
SMILES:
O=S(C1=NC2=C(N1)C=CC=C2)(CC3=NC=CC(OCCCOC)=C3C)=O
Tpsa:
94.17
Logp:
2.65552
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
8
Purity: 98%
MDL No: None
Storage: -20°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₄H₁₇FN₆O
Molecular Weight: 424.43
Synonyms: None
SMILES: N#CC1=C(C2=C(C3=CC4=C(C(NN=C4CN)=O)C=C3)C=NN2C)C(F)=CC5=C1C=CC=C5
Tpsa: 113.38
Logp: 3.61328
H Acceptors: 6
H Donors: 2
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
-20°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₁₇FN₆O
Molecular Weight:
424.43
Synonyms:
None
SMILES:
N#CC1=C(C2=C(C3=CC4=C(C(NN=C4CN)=O)C=C3)C=NN2C)C(F)=CC5=C1C=CC=C5
Tpsa:
113.38
Logp:
3.61328
H Acceptors:
6
H Donors:
2
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: C₁₈H₁₉ClN₂O₆S
Molecular Weight: 426.87
Synonyms: N-[[4-[2-[(5-Chloro-2-methoxybenzoyl)amino]ethyl]phenyl]sulfonyl]carbamic Acid Methyl Ester
SMILES: O=C(OC)NS(=O)(C1=CC=C(CCNC(C2=CC(Cl)=CC=C2OC)=O)C=C1)=O
Tpsa: 110.8
Logp: 2.3658
H Acceptors: 6
H Donors: 2
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:
C₁₈H₁₉ClN₂O₆S
Molecular Weight:
426.87
Synonyms:
N-[[4-[2-[(5-Chloro-2-methoxybenzoyl)amino]ethyl]phenyl]sulfonyl]carbamic Acid Methyl Ester
SMILES:
O=C(OC)NS(=O)(C1=CC=C(CCNC(C2=CC(Cl)=CC=C2OC)=O)C=C1)=O
Tpsa:
110.8
Logp:
2.3658
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
7