CS-1001480
Atogepant Impurity 38
Manufacturer: ChemScene
CAS Number: 1455358-09-4
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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
C₂₃H₂₆ClN₃O₃
Molecular Weight
427.92
Synonyms
None
SMILES
C(=C/1\C=2C(N(C(C)(C)C)C1=O)=NC=CC2)\C3=C(COC4CCCCO4)C=C(Cl)C=N3
Tpsa
64.55
Logp
4.8589
H Acceptors
5
H Donors
0
Rotatable Bonds
4
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1455358-09-4 | | A2B Chem | -- |
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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: C₂₃H₂₆ClN₃O₃
Molecular Weight: 427.92
Synonyms: None
SMILES: C(=C/1\C=2C(N(C(C)(C)C)C1=O)=NC=CC2)\C3=C(COC4CCCCO4)C=C(Cl)C=N3
Tpsa: 64.55
Logp: 4.8589
H Acceptors: 5
H Donors: 0
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:
C₂₃H₂₆ClN₃O₃
Molecular Weight:
427.92
Synonyms:
None
SMILES:
C(=C/1\C=2C(N(C(C)(C)C)C1=O)=NC=CC2)\C3=C(COC4CCCCO4)C=C(Cl)C=N3
Tpsa:
64.55
Logp:
4.8589
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
4
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₂₀ClN₃O₂
Molecular Weight: 345.82
Synonyms: None
SMILES: O=C1N(C2=NC=CC=C2C1CC3=NC=C(Cl)C=C3CO)C(C)(C)C
Tpsa: 66.32
Logp: 3.0937
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 3
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₂₀ClN₃O₂
Molecular Weight:
345.82
Synonyms:
None
SMILES:
O=C1N(C2=NC=CC=C2C1CC3=NC=C(Cl)C=C3CO)C(C)(C)C
Tpsa:
66.32
Logp:
3.0937
H Acceptors:
4
H Donors:
1
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: C₁₇H₁₆N₂O₇
Molecular Weight: 360.32
Synonyms: None
SMILES: O=C(OC)C1=C(N=C(C(C(=O)OC)=C1C=2C=CC=CC2N(=O)=O)CO)C
Tpsa: 128.86
Logp: 2.03072
H Acceptors: 8
H Donors: 1
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:
C₁₇H₁₆N₂O₇
Molecular Weight:
360.32
Synonyms:
None
SMILES:
O=C(OC)C1=C(N=C(C(C(=O)OC)=C1C=2C=CC=CC2N(=O)=O)CO)C
Tpsa:
128.86
Logp:
2.03072
H Acceptors:
8
H Donors:
1
Rotatable Bonds:
5
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₉F₂NO₄
Molecular Weight: 327.32
Synonyms: None
SMILES: N(C(OC(C)(C)C)=O)[C@H]1[C@@H](OCC(=O)C1)C2=C(F)C=CC(F)=C2
Tpsa: 64.63
Logp: 2.8886
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 2
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₉F₂NO₄
Molecular Weight:
327.32
Synonyms:
None
SMILES:
N(C(OC(C)(C)C)=O)[C@H]1[C@@H](OCC(=O)C1)C2=C(F)C=CC(F)=C2
Tpsa:
64.63
Logp:
2.8886
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2