CS-0377425
Ethyl 1-(5-((4-(5-bromo-4-chlorothiophen-2-yl)-5-(4-cyclohexylpiperazin-1-yl)thiazol-2-yl)carbamoyl)-3-chloropyridin-2-yl)piperidine-4-carboxylate 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
C₃₁H₃₇BrCl₂N₆O₃S₂
Molecular Weight
756.60
Synonyms
None
SMILES
ClC1=C(N2CCC(C(OCC)=O)CC2)N=CC(C(NC(S3)=NC(C4=CC(Cl)=C(Br)S4)=C3N(CC5)CCN5C6CCCCC6)=O)=C1
Tpsa
90.9
Logp
7.8224
H Acceptors
10
H Donors
1
Rotatable Bonds
8
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: C₃₁H₃₇BrCl₂N₆O₃S₂
Molecular Weight: 756.60
Synonyms: None
SMILES: ClC1=C(N2CCC(C(OCC)=O)CC2)N=CC(C(NC(S3)=NC(C4=CC(Cl)=C(Br)S4)=C3N(CC5)CCN5C6CCCCC6)=O)=C1
Tpsa: 90.9
Logp: 7.8224
H Acceptors: 10
H Donors: 1
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₁H₃₇BrCl₂N₆O₃S₂
Molecular Weight:
756.60
Synonyms:
None
SMILES:
ClC1=C(N2CCC(C(OCC)=O)CC2)N=CC(C(NC(S3)=NC(C4=CC(Cl)=C(Br)S4)=C3N(CC5)CCN5C6CCCCC6)=O)=C1
Tpsa:
90.9
Logp:
7.8224
H Acceptors:
10
H Donors:
1
Rotatable Bonds:
8
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₁H₃₇Cl₃N₆O₃S₂
Molecular Weight: 712.15
Synonyms: None
SMILES: ClC1=C(N2CCC(C(OCC)=O)CC2)N=CC(C(NC(S3)=NC(C4=CC(Cl)=C(Cl)S4)=C3N(CC5)CCN5C6CCCCC6)=O)=C1
Tpsa: 90.9
Logp: 7.7133
H Acceptors: 10
H Donors: 1
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₁H₃₇Cl₃N₆O₃S₂
Molecular Weight:
712.15
Synonyms:
None
SMILES:
ClC1=C(N2CCC(C(OCC)=O)CC2)N=CC(C(NC(S3)=NC(C4=CC(Cl)=C(Cl)S4)=C3N(CC5)CCN5C6CCCCC6)=O)=C1
Tpsa:
90.9
Logp:
7.7133
H Acceptors:
10
H Donors:
1
Rotatable Bonds:
8
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: INDEX NAME NOT YET ASSIGNED
SMILES: ClC1=C(N2CCC(C(O)=O)CC2)N=CC(C(NC(S3)=NC(C4=CC(Cl)=CS4)=C3N(CC5)CC[N+]5([O-])C6CCCCC6)=O)=C1
Tpsa: 121.72
Logp: 6.594
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:
INDEX NAME NOT YET ASSIGNED
SMILES:
ClC1=C(N2CCC(C(O)=O)CC2)N=CC(C(NC(S3)=NC(C4=CC(Cl)=CS4)=C3N(CC5)CC[N+]5([O-])C6CCCCC6)=O)=C1
Tpsa:
121.72
Logp:
6.594
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: C₃₁H₃₈Cl₂N₆O₄S₂
Molecular Weight: 693.71
Synonyms: None
SMILES: ClC1=C(N2CCC(C(OCC)=O)CC2)N=CC(C(NC(S3)=NC(C4=CC(Cl)=CS4)=C3N(CC5)CC[N+]5([O-])C6CCCCC6)=O)=C1
Tpsa: 110.72
Logp: 7.0725
H Acceptors: 10
H Donors: 1
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₁H₃₈Cl₂N₆O₄S₂
Molecular Weight:
693.71
Synonyms:
None
SMILES:
ClC1=C(N2CCC(C(OCC)=O)CC2)N=CC(C(NC(S3)=NC(C4=CC(Cl)=CS4)=C3N(CC5)CC[N+]5([O-])C6CCCCC6)=O)=C1
Tpsa:
110.72
Logp:
7.0725
H Acceptors:
10
H Donors:
1
Rotatable Bonds:
8