CS-0571902
Ethyl 4-hydroxy-1-methyl-7-phenoxyisoquinoline-3-carboxylate
Manufacturer: ChemScene
CAS Number: 1809286-36-9
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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
C₁₉H₁₇NO₄
Molecular Weight
323.34
Synonyms
4-hydroxy-1-methyl-7-phenoxy-3-Isoquinolinecarboxylic acid ethyl ester
SMILES
CCOC(=O)C1=NC(=C2C=C(C=CC2=C1O)OC3=CC=CC=C3)C
Tpsa
68.65
Logp
4.21782
H Acceptors
5
H Donors
1
Rotatable Bonds
4
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: C₁₉H₁₇NO₄
Molecular Weight: 323.34
Synonyms: 4-hydroxy-1-methyl-7-phenoxy-3-Isoquinolinecarboxylic acid ethyl ester
SMILES: CCOC(=O)C1=NC(=C2C=C(C=CC2=C1O)OC3=CC=CC=C3)C
Tpsa: 68.65
Logp: 4.21782
H Acceptors: 5
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:
C₁₉H₁₇NO₄
Molecular Weight:
323.34
Synonyms:
4-hydroxy-1-methyl-7-phenoxy-3-Isoquinolinecarboxylic acid ethyl ester
SMILES:
CCOC(=O)C1=NC(=C2C=C(C=CC2=C1O)OC3=CC=CC=C3)C
Tpsa:
68.65
Logp:
4.21782
H Acceptors:
5
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: C₇H₉N₃O₃
Molecular Weight: 183.16
Synonyms: N-(2-methyl-4,6-dioxo-1H-pyrimidin-5-yl)acetamide
SMILES: CC1=NC(=O)C(C(=O)N1)NC(=O)C
Tpsa: 87.63
Logp: -1.4341
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₉N₃O₃
Molecular Weight:
183.16
Synonyms:
N-(2-methyl-4,6-dioxo-1H-pyrimidin-5-yl)acetamide
SMILES:
CC1=NC(=O)C(C(=O)N1)NC(=O)C
Tpsa:
87.63
Logp:
-1.4341
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₁₂O₂S₃
Molecular Weight: 224.36
Synonyms: 2-{[(Ethylsulfanyl)carbonothioyl]sulfanyl}-2-methylpropanoic acid
SMILES: CCSC(=S)SC(C)(C)C(=O)O
Tpsa: 37.3
Logp: 2.6208
H Acceptors: 4
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:
C₇H₁₂O₂S₃
Molecular Weight:
224.36
Synonyms:
2-{[(Ethylsulfanyl)carbonothioyl]sulfanyl}-2-methylpropanoic acid
SMILES:
CCSC(=S)SC(C)(C)C(=O)O
Tpsa:
37.3
Logp:
2.6208
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₇H₂₄N₄O₄
Molecular Weight: 468.50
Synonyms: 1-[4-[5-(4-Pentyloxyphenyl)isoxazol-3-yl]benzoyloxy]-1H-1,2,3-benzotriazole
SMILES: O=C(ON1N=NC2=CC=CC=C21)C3=CC=C(C4=NOC(C5=CC=C(OCCCCC)C=C5)=C4)C=C3
Tpsa: 92.27
Logp: 5.5913
H Acceptors: 8
H Donors: 0
Rotatable Bonds: 9
Purity:
98%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₇H₂₄N₄O₄
Molecular Weight:
468.50
Synonyms:
1-[4-[5-(4-Pentyloxyphenyl)isoxazol-3-yl]benzoyloxy]-1H-1,2,3-benzotriazole
SMILES:
O=C(ON1N=NC2=CC=CC=C21)C3=CC=C(C4=NOC(C5=CC=C(OCCCCC)C=C5)=C4)C=C3
Tpsa:
92.27
Logp:
5.5913
H Acceptors:
8
H Donors:
0
Rotatable Bonds:
9