CS-0914610
Bosentan Impurity 5
Manufacturer: ChemScene
CAS Number: 1355251-10-3
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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
C₂₀H₂₇NO₄S₂
Molecular Weight
409.56
Synonyms
None
SMILES
O=S(=O)(NS(=O)(=O)C1=CC=C(C=C1)C(C)(C)C)C2=CC=C(C=C2)C(C)(C)C
Tpsa
80.31
Logp
3.9488
H Acceptors
4
H Donors
1
Rotatable Bonds
4
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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: C₂₀H₂₇NO₄S₂
Molecular Weight: 409.56
Synonyms: None
SMILES: O=S(=O)(NS(=O)(=O)C1=CC=C(C=C1)C(C)(C)C)C2=CC=C(C=C2)C(C)(C)C
Tpsa: 80.31
Logp: 3.9488
H Acceptors: 4
H Donors: 1
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:
C₂₀H₂₇NO₄S₂
Molecular Weight:
409.56
Synonyms:
None
SMILES:
O=S(=O)(NS(=O)(=O)C1=CC=C(C=C1)C(C)(C)C)C2=CC=C(C=C2)C(C)(C)C
Tpsa:
80.31
Logp:
3.9488
H Acceptors:
4
H Donors:
1
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: C₁₉H₁₅Cl₂N₃O₃
Molecular Weight: 404.25
Synonyms: None
SMILES: N#CC1=CN=C2C=C(OC)C(OC)=CC2=C1NC3=CC(OC)=C(Cl)C=C3Cl
Tpsa: 76.4
Logp: 5.18268
H Acceptors: 6
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:
C₁₉H₁₅Cl₂N₃O₃
Molecular Weight:
404.25
Synonyms:
None
SMILES:
N#CC1=CN=C2C=C(OC)C(OC)=CC2=C1NC3=CC(OC)=C(Cl)C=C3Cl
Tpsa:
76.4
Logp:
5.18268
H Acceptors:
6
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: C₃₉H₃₀Cl₄N₆O₆
Molecular Weight: 820.50
Synonyms: None
SMILES: N#CC1=CN=C2C=C(OCCCOC3=CC4=NC=C(C#N)C(NC5=CC(OC)=C(Cl)C=C5Cl)=C4C=C3OC)C(OC)=CC2=C1NC6=CC(OC)=C(Cl)C=C6Cl
Tpsa: 152.8
Logp: 10.50946
H Acceptors: 12
H Donors: 2
Rotatable Bonds: 14
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₉H₃₀Cl₄N₆O₆
Molecular Weight:
820.50
Synonyms:
None
SMILES:
N#CC1=CN=C2C=C(OCCCOC3=CC4=NC=C(C#N)C(NC5=CC(OC)=C(Cl)C=C5Cl)=C4C=C3OC)C(OC)=CC2=C1NC6=CC(OC)=C(Cl)C=C6Cl
Tpsa:
152.8
Logp:
10.50946
H Acceptors:
12
H Donors:
2
Rotatable Bonds:
14
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₂BrNO₄
Molecular Weight: 290.11
Synonyms: None
SMILES: O=N(=O)C1=CC=C(OC)C(OCCCBr)=C1
Tpsa: 61.6
Logp: 2.7672
H Acceptors: 4
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:
C₁₀H₁₂BrNO₄
Molecular Weight:
290.11
Synonyms:
None
SMILES:
O=N(=O)C1=CC=C(OC)C(OCCCBr)=C1
Tpsa:
61.6
Logp:
2.7672
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
6