CS-0800232
2-[2-(4-Amino-3-methyl-phenoxy)ethyl]-5-chloro-isoquinolin-1-one
Manufacturer: ChemScene
CAS Number: 2327820-94-8
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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
C₁₈H₁₇ClN₂O₂
Molecular Weight
328.79
Synonyms
None
SMILES
CC1=C(N)C=CC(OCCN2C(=O)C3C(C=C2)=C(Cl)C=CC=3)=C1
Tpsa
57.25
Logp
3.62452
H Acceptors
4
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: C₁₈H₁₇ClN₂O₂
Molecular Weight: 328.79
Synonyms: None
SMILES: CC1=C(N)C=CC(OCCN2C(=O)C3C(C=C2)=C(Cl)C=CC=3)=C1
Tpsa: 57.25
Logp: 3.62452
H Acceptors: 4
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:
C₁₈H₁₇ClN₂O₂
Molecular Weight:
328.79
Synonyms:
None
SMILES:
CC1=C(N)C=CC(OCCN2C(=O)C3C(C=C2)=C(Cl)C=CC=3)=C1
Tpsa:
57.25
Logp:
3.62452
H Acceptors:
4
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: C₉H₁₃ClO₂
Molecular Weight: 188.65
Synonyms: None
SMILES: ClCC(=O)C1CC2(COCC2)C1
Tpsa: 26.3
Logp: 1.611
H Acceptors: 2
H Donors: 0
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:
C₉H₁₃ClO₂
Molecular Weight:
188.65
Synonyms:
None
SMILES:
ClCC(=O)C1CC2(COCC2)C1
Tpsa:
26.3
Logp:
1.611
H Acceptors:
2
H Donors:
0
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: C₈H₈F₃N₃O
Molecular Weight: 219.16
Synonyms: None
SMILES: O=C1C2=C(CNCC2)C(=NN1)C(F)(F)F
Tpsa: 57.78
Logp: 0.4344
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₈F₃N₃O
Molecular Weight:
219.16
Synonyms:
None
SMILES:
O=C1C2=C(CNCC2)C(=NN1)C(F)(F)F
Tpsa:
57.78
Logp:
0.4344
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₁₄ClNO
Molecular Weight: 283.75
Synonyms: None
SMILES: C1=CC=C(C=C1)CN2C(=O)C3C(=C(Cl)C=CC=3)C=C2C
Tpsa: 22
Logp: 4.01162
H Acceptors: 2
H Donors: 0
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:
C₁₇H₁₄ClNO
Molecular Weight:
283.75
Synonyms:
None
SMILES:
C1=CC=C(C=C1)CN2C(=O)C3C(=C(Cl)C=CC=3)C=C2C
Tpsa:
22
Logp:
4.01162
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
2