CS-0377415
4-Carboxy-1-(3-chloro-5-((4-(4-chlorothiophen-2-yl)-5-(4-cyclohexylpiperazin-1-yl)thiazol-2-yl)carbamoyl)pyridin-2-yl)piperidine 1-oxide Avatrombopag Impurity
Manufacturer: ChemScene
CAS Number: None
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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
C₂₉H₃₄Cl₂N₆O₄S₂
Molecular Weight
665.65
Synonyms
None
SMILES
ClC1=CSC(C(N=C(NC(C2=CC(Cl)=C([N+]3([O-])CCC(C(O)=O)CC3)N=C2)=O)S4)=C4N(CC5)CCN5C6CCCCC6)=C1
Tpsa
121.72
Logp
6.5801
H Acceptors
9
H Donors
2
Rotatable Bonds
7
Other Options
...
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: C₂₉H₃₄Cl₂N₆O₄S₂
Molecular Weight: 665.65
Synonyms: None
SMILES: ClC1=CSC(C(N=C(NC(C2=CC(Cl)=C([N+]3([O-])CCC(C(O)=O)CC3)N=C2)=O)S4)=C4N(CC5)CCN5C6CCCCC6)=C1
Tpsa: 121.72
Logp: 6.5801
H Acceptors: 9
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:
C₂₉H₃₄Cl₂N₆O₄S₂
Molecular Weight:
665.65
Synonyms:
None
SMILES:
ClC1=CSC(C(N=C(NC(C2=CC(Cl)=C([N+]3([O-])CCC(C(O)=O)CC3)N=C2)=O)S4)=C4N(CC5)CCN5C6CCCCC6)=C1
Tpsa:
121.72
Logp:
6.5801
H Acceptors:
9
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: C₂₉H₃₄BrClN₆O₃S₂
Molecular Weight: 694.11
Synonyms: None
SMILES: ClC1=CSC(C(N=C(NC(C2=CC(Br)=C(N3CCC(C(O)=O)CC3)N=C2)=O)S4)=C4N(CC5)CCN5C6CCCCC6)=C1
Tpsa: 101.9
Logp: 6.6905
H Acceptors: 9
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:
C₂₉H₃₄BrClN₆O₃S₂
Molecular Weight:
694.11
Synonyms:
None
SMILES:
ClC1=CSC(C(N=C(NC(C2=CC(Br)=C(N3CCC(C(O)=O)CC3)N=C2)=O)S4)=C4N(CC5)CCN5C6CCCCC6)=C1
Tpsa:
101.9
Logp:
6.6905
H Acceptors:
9
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: C₁₇H₂₃ClN₄S₂
Molecular Weight: 382.97
Synonyms: Avatrombopag Impurity 71
SMILES: NC(S1)=NC(C2=CC=C(Cl)S2)=C1N(CC3)CCN3C4CCCCC4
Tpsa: 45.39
Logp: 4.5619
H Acceptors: 6
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:
C₁₇H₂₃ClN₄S₂
Molecular Weight:
382.97
Synonyms:
Avatrombopag Impurity 71
SMILES:
NC(S1)=NC(C2=CC=C(Cl)S2)=C1N(CC3)CCN3C4CCCCC4
Tpsa:
45.39
Logp:
4.5619
H Acceptors:
6
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: C₂₉H₃₄Cl₂N₆O₃S₂
Molecular Weight: 649.65
Synonyms: None
SMILES: ClC1=C(N2CCC(C(O)=O)CC2)N=CC(C(NC(S3)=NC(C4=CC=C(Cl)S4)=C3N(CC5)CCN5C6CCCCC6)=O)=C1
Tpsa: 101.9
Logp: 6.5814
H Acceptors: 9
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:
C₂₉H₃₄Cl₂N₆O₃S₂
Molecular Weight:
649.65
Synonyms:
None
SMILES:
ClC1=C(N2CCC(C(O)=O)CC2)N=CC(C(NC(S3)=NC(C4=CC=C(Cl)S4)=C3N(CC5)CCN5C6CCCCC6)=O)=C1
Tpsa:
101.9
Logp:
6.5814
H Acceptors:
9
H Donors:
2
Rotatable Bonds:
7