CS-1001363
Eletriptan Impurity 4
Manufacturer: ChemScene
CAS Number: 1422285-51-5
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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
C₄₄H₅₀N₄O₄S₂
Molecular Weight
763.02
Synonyms
None
SMILES
C(C(CS(=O)(=O)C1=CC=CC=C1)C=2C=C3C(C[C@@H]4N(C)CCC4)=CNC3=CC2)(CS(=O)(=O)C5=CC=CC=C5)C=6C=C7C(C[C@@H]8N(C)CCC8)=CNC7=CC6
Tpsa
106.34
Logp
7.7378
H Acceptors
6
H Donors
2
Rotatable Bonds
13
Related Products
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: C₄₄H₅₀N₄O₄S₂
Molecular Weight: 763.02
Synonyms: None
SMILES: C(C(CS(=O)(=O)C1=CC=CC=C1)C=2C=C3C(C[C@@H]4N(C)CCC4)=CNC3=CC2)(CS(=O)(=O)C5=CC=CC=C5)C=6C=C7C(C[C@@H]8N(C)CCC8)=CNC7=CC6
Tpsa: 106.34
Logp: 7.7378
H Acceptors: 6
H Donors: 2
Rotatable Bonds: 13
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄₄H₅₀N₄O₄S₂
Molecular Weight:
763.02
Synonyms:
None
SMILES:
C(C(CS(=O)(=O)C1=CC=CC=C1)C=2C=C3C(C[C@@H]4N(C)CCC4)=CNC3=CC2)(CS(=O)(=O)C5=CC=CC=C5)C=6C=C7C(C[C@@H]8N(C)CCC8)=CNC7=CC6
Tpsa:
106.34
Logp:
7.7378
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
13
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₁H₂₃N₃O₄
Molecular Weight: 381.43
Synonyms: None
SMILES: O=C(OCC)C1=CC=C(C=C1)NCC2=NC=3C=C(C=CC3N2C)C(=O)OCC
Tpsa: 82.45
Logp: 3.5388
H Acceptors: 7
H Donors: 1
Rotatable Bonds: 7
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₁H₂₃N₃O₄
Molecular Weight:
381.43
Synonyms:
None
SMILES:
O=C(OCC)C1=CC=C(C=C1)NCC2=NC=3C=C(C=CC3N2C)C(=O)OCC
Tpsa:
82.45
Logp:
3.5388
H Acceptors:
7
H Donors:
1
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: C₂₈H₃₀N₆O₄
Molecular Weight: 514.58
Synonyms: None
SMILES: O=C(OC)CCN(C(=O)C=1C=CC2=C(N=C(N2C)CNC3=CC=C(C=C3)C(=N)OCC)C1)C4=NC=CC=C4
Tpsa: 122.43
Logp: 4.15217
H Acceptors: 9
H Donors: 2
Rotatable Bonds: 10
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₈H₃₀N₆O₄
Molecular Weight:
514.58
Synonyms:
None
SMILES:
O=C(OC)CCN(C(=O)C=1C=CC2=C(N=C(N2C)CNC3=CC=C(C=C3)C(=N)OCC)C1)C4=NC=CC=C4
Tpsa:
122.43
Logp:
4.15217
H Acceptors:
9
H Donors:
2
Rotatable Bonds:
10
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₉H₃₁N₅O₅
Molecular Weight: 529.59
Synonyms: None
SMILES: O=C(OCC)C1=CC=C(C=C1)NCC2=NC=3C=C(C=CC3N2C)C(=O)N(C4=NC=CC=C4)CCC(=O)OCC
Tpsa: 115.65
Logp: 4.3571
H Acceptors: 9
H Donors: 1
Rotatable Bonds: 11
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₉H₃₁N₅O₅
Molecular Weight:
529.59
Synonyms:
None
SMILES:
O=C(OCC)C1=CC=C(C=C1)NCC2=NC=3C=C(C=CC3N2C)C(=O)N(C4=NC=CC=C4)CCC(=O)OCC
Tpsa:
115.65
Logp:
4.3571
H Acceptors:
9
H Donors:
1
Rotatable Bonds:
11