CS-1001280
Rimegepant Impurity 13
Manufacturer: ChemScene
CAS Number: 1397526-11-2
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Purity
95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₅H₃₃F₂NO₂Si
Molecular Weight
445.62
Synonyms
None
SMILES
O([Si](C(C)C)(C(C)C)C(C)C)[C@@H]1C=2C(C(=O)[C@H](CC1)C3=C(F)C(F)=CC=C3)=CC=CN2
Tpsa
39.19
Logp
7.3533
H Acceptors
3
H Donors
0
Rotatable Bonds
6
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1397526-11-2 | (6R,9S)-6-(2,3-Difluorophenyl)-6,7,8,9-tetrahydro-9-[[tris(1-methylethyl)silyl]oxy]-5H-cyclohepta[b]pyridin-5-one | 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: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₅H₃₃F₂NO₂Si
Molecular Weight: 445.62
Synonyms: None
SMILES: O([Si](C(C)C)(C(C)C)C(C)C)[C@@H]1C=2C(C(=O)[C@H](CC1)C3=C(F)C(F)=CC=C3)=CC=CN2
Tpsa: 39.19
Logp: 7.3533
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 6
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₅H₃₃F₂NO₂Si
Molecular Weight:
445.62
Synonyms:
None
SMILES:
O([Si](C(C)C)(C(C)C)C(C)C)[C@@H]1C=2C(C(=O)[C@H](CC1)C3=C(F)C(F)=CC=C3)=CC=CN2
Tpsa:
39.19
Logp:
7.3533
H Acceptors:
3
H Donors:
0
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: C₂₆H₃₈O₆
Molecular Weight: 446.58
Synonyms: None
SMILES: O(C(CCCC)=O)[C@@]1(C(CO)=O)[C@]2(C)[C@@](CC1)([C@]3([C@]([C@H](O)C2)([C@]4(C)C(CC3)=CC(=O)CC4)[H])[H])[H]
Tpsa: 100.9
Logp: 3.5227
H Acceptors: 6
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:
C₂₆H₃₈O₆
Molecular Weight:
446.58
Synonyms:
None
SMILES:
O(C(CCCC)=O)[C@@]1(C(CO)=O)[C@]2(C)[C@@](CC1)([C@]3([C@]([C@H](O)C2)([C@]4(C)C(CC3)=CC(=O)CC4)[H])[H])[H]
Tpsa:
100.9
Logp:
3.5227
H Acceptors:
6
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: C₇H₉BrO₂
Molecular Weight: 205.05
Synonyms: None
SMILES: Br[C@@H]1[C@@]2(C[C@@](C(=O)O2)(CC1)[H])[H]
Tpsa: 26.3
Logp: 1.4754
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₉BrO₂
Molecular Weight:
205.05
Synonyms:
None
SMILES:
Br[C@@H]1[C@@]2(C[C@@](C(=O)O2)(CC1)[H])[H]
Tpsa:
26.3
Logp:
1.4754
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₇ClN₄O₂
Molecular Weight: 262.65
Synonyms: None
SMILES: O[C@@H]1N(C(=O)C=2C1=NC=CN2)C3=CC=C(Cl)C=N3
Tpsa: 79.21
Logp: 1.1763
H Acceptors: 5
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:
C₁₁H₇ClN₄O₂
Molecular Weight:
262.65
Synonyms:
None
SMILES:
O[C@@H]1N(C(=O)C=2C1=NC=CN2)C3=CC=C(Cl)C=N3
Tpsa:
79.21
Logp:
1.1763
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
1