CS-1001022
2-[2-[[4-[(3-Ethynylphenyl)amino]-6-(2-hydroxyethoxy)-7-quinazolinyl]oxy]ethoxy]acetic acid
Manufacturer: ChemScene
CAS Number: 1318599-96-0
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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
C₂₂H₂₁N₃O₆
Molecular Weight
423.42
Synonyms
None
SMILES
O=C(O)COCCOC1=CC2=NC=NC(NC=3C=CC=C(C#C)C3)=C2C=C1OCCO
Tpsa
123.03
Logp
2.2058
H Acceptors
8
H Donors
3
Rotatable Bonds
11
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: C₂₂H₂₁N₃O₆
Molecular Weight: 423.42
Synonyms: None
SMILES: O=C(O)COCCOC1=CC2=NC=NC(NC=3C=CC=C(C#C)C3)=C2C=C1OCCO
Tpsa: 123.03
Logp: 2.2058
H Acceptors: 8
H Donors: 3
Rotatable Bonds: 11
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₂H₂₁N₃O₆
Molecular Weight:
423.42
Synonyms:
None
SMILES:
O=C(O)COCCOC1=CC2=NC=NC(NC=3C=CC=C(C#C)C3)=C2C=C1OCCO
Tpsa:
123.03
Logp:
2.2058
H Acceptors:
8
H Donors:
3
Rotatable Bonds:
11
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₂H₂₃N₃O₅
Molecular Weight: 409.44
Synonyms: None
SMILES: C#CC1=CC=CC(=C1)NC=2N=CN=C3C=C(OCCOCCO)C(OCCO)=CC32
Tpsa: 105.96
Logp: 2.1135
H Acceptors: 8
H Donors: 3
Rotatable Bonds: 11
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₂H₂₃N₃O₅
Molecular Weight:
409.44
Synonyms:
None
SMILES:
C#CC1=CC=CC(=C1)NC=2N=CN=C3C=C(OCCOCCO)C(OCCO)=CC32
Tpsa:
105.96
Logp:
2.1135
H Acceptors:
8
H Donors:
3
Rotatable Bonds:
11
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₂H₂₃N₃O₆
Molecular Weight: 425.43
Synonyms: None
SMILES: O=C(O)CC=1C=CC=C(C1)NC=2N=CN=C3C=C4OCCOCCOCCOC4=CC32
Tpsa: 112.03
Logp: 2.8049
H Acceptors: 8
H Donors: 2
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:
C₂₂H₂₃N₃O₆
Molecular Weight:
425.43
Synonyms:
None
SMILES:
O=C(O)CC=1C=CC=C(C1)NC=2N=CN=C3C=C4OCCOCCOCCOC4=CC32
Tpsa:
112.03
Logp:
2.8049
H Acceptors:
8
H Donors:
2
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: C₁₆H₁₆BrClO₂
Molecular Weight: 355.65
Synonyms: None
SMILES: ClC1=CC=C(Br)C=C1C(OC)C2=CC=C(OCC)C=C2
Tpsa: 18.46
Logp: 5.237
H Acceptors: 2
H Donors: 0
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:
C₁₆H₁₆BrClO₂
Molecular Weight:
355.65
Synonyms:
None
SMILES:
ClC1=CC=C(Br)C=C1C(OC)C2=CC=C(OCC)C=C2
Tpsa:
18.46
Logp:
5.237
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
5