CS-1002763
2-[2-[[4-[(3-Ethynylphenyl)amino]-7-(2-hydroxyethoxy)-6-quinazolinyl]oxy]ethoxy]acetic acid
Manufacturer: ChemScene
CAS Number: 2218487-28-4
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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=CC=2C(=NC=NC2NC=3C=CC=C(C#C)C3)C=C1OCCO
Tpsa
123.03
Logp
2.2058
H Acceptors
8
H Donors
3
Rotatable Bonds
11
SAFETY INFORMATION
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=CC=2C(=NC=NC2NC=3C=CC=C(C#C)C3)C=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=CC=2C(=NC=NC2NC=3C=CC=C(C#C)C3)C=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: C₇H₆FNO₄
Molecular Weight: 187.13
Synonyms: None
SMILES: O=N(=O)C=1C=C(F)C=C(OC)C1O
Tpsa: 72.6
Logp: 1.4481
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₆FNO₄
Molecular Weight:
187.13
Synonyms:
None
SMILES:
O=N(=O)C=1C=C(F)C=C(OC)C1O
Tpsa:
72.6
Logp:
1.4481
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₈H₅₈N₈O₆
Molecular Weight: 722.92
Synonyms: None
SMILES: C([C@H](NC([C@H](NC([C@@H](CC1=CC=CC=C1)NC([C@@H](CC2=CC=CC=C2)N)=O)=O)CC(C)C)=O)CCCCNCCN)(=O)N3CCC(C(O)=O)(N)CC3
Tpsa: 235
Logp: 0.4227
H Acceptors: 9
H Donors: 8
Rotatable Bonds: 21
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₈H₅₈N₈O₆
Molecular Weight:
722.92
Synonyms:
None
SMILES:
C([C@H](NC([C@H](NC([C@@H](CC1=CC=CC=C1)NC([C@@H](CC2=CC=CC=C2)N)=O)=O)CC(C)C)=O)CCCCNCCN)(=O)N3CCC(C(O)=O)(N)CC3
Tpsa:
235
Logp:
0.4227
H Acceptors:
9
H Donors:
8
Rotatable Bonds:
21
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₉H₆₀N₈O₆
Molecular Weight: 736.94
Synonyms: None
SMILES: C([C@H](NC([C@H](NC([C@@H](CC1=CC=CC=C1)NC([C@@H](CC2=CC=CC=C2)N)=O)=O)CC(C)C)=O)CCCCNCCCN)(=O)N3CCC(C(O)=O)(N)CC3
Tpsa: 235
Logp: 0.8128
H Acceptors: 9
H Donors: 8
Rotatable Bonds: 22
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₉H₆₀N₈O₆
Molecular Weight:
736.94
Synonyms:
None
SMILES:
C([C@H](NC([C@H](NC([C@@H](CC1=CC=CC=C1)NC([C@@H](CC2=CC=CC=C2)N)=O)=O)CC(C)C)=O)CCCCNCCCN)(=O)N3CCC(C(O)=O)(N)CC3
Tpsa:
235
Logp:
0.8128
H Acceptors:
9
H Donors:
8
Rotatable Bonds:
22