CS-0530289
(S)-1-tert-Butyl 3-methyl 4-(7-bromo-6-chloro-8-fluoro-3-nitroquinolin-4-yl)piperazine-1,3-dicarboxylate
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
C₂₀H₂₁BrClFN₄O₆
Molecular Weight
547.76
Synonyms
None
SMILES
FC1=C2C(C(N3CCN(C(OC(C)(C)C)=O)C[C@H]3C(OC)=O)=C([N+]([O-])=O)C=N2)=CC(Cl)=C1Br
Tpsa
115.11
Logp
4.2967
H Acceptors
8
H Donors
0
Rotatable Bonds
3
Other Options
...
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: C₂₀H₂₁BrClFN₄O₆
Molecular Weight: 547.76
Synonyms: None
SMILES: FC1=C2C(C(N3CCN(C(OC(C)(C)C)=O)C[C@H]3C(OC)=O)=C([N+]([O-])=O)C=N2)=CC(Cl)=C1Br
Tpsa: 115.11
Logp: 4.2967
H Acceptors: 8
H Donors: 0
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:
C₂₀H₂₁BrClFN₄O₆
Molecular Weight:
547.76
Synonyms:
None
SMILES:
FC1=C2C(C(N3CCN(C(OC(C)(C)C)=O)C[C@H]3C(OC)=O)=C([N+]([O-])=O)C=N2)=CC(Cl)=C1Br
Tpsa:
115.11
Logp:
4.2967
H Acceptors:
8
H Donors:
0
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: C₁₀H₉FO
Molecular Weight: 164.18
Synonyms: 3-Butyn-2-ol,4-(4-fluorophenyl)-(9CI)
SMILES: CC(O)C#CC1=CC=C(F)C=C1
Tpsa: 20.23
Logp: 1.558
H Acceptors: 1
H Donors: 1
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:
C₁₀H₉FO
Molecular Weight:
164.18
Synonyms:
3-Butyn-2-ol,4-(4-fluorophenyl)-(9CI)
SMILES:
CC(O)C#CC1=CC=C(F)C=C1
Tpsa:
20.23
Logp:
1.558
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: MFCD14584906
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₇FO
Molecular Weight: 162.16
Synonyms: 3-Butyn-2-one,4-(4-fluorophenyl)-(9CI)
SMILES: CC(C#CC1=CC=C(F)C=C1)=O
Tpsa: 17.07
Logp: 1.7662
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
MFCD14584906
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₇FO
Molecular Weight:
162.16
Synonyms:
3-Butyn-2-one,4-(4-fluorophenyl)-(9CI)
SMILES:
CC(C#CC1=CC=C(F)C=C1)=O
Tpsa:
17.07
Logp:
1.7662
H Acceptors:
1
H Donors:
0
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: C₁₁H₁₀O₂
Molecular Weight: 174.20
Synonyms: 4-(4-methoxyphenyl)but--3-yn-2-one
SMILES: CC(C#CC1=CC=C(OC)C=C1)=O
Tpsa: 26.3
Logp: 1.6357
H Acceptors: 2
H Donors: 0
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:
C₁₁H₁₀O₂
Molecular Weight:
174.20
Synonyms:
4-(4-methoxyphenyl)but--3-yn-2-one
SMILES:
CC(C#CC1=CC=C(OC)C=C1)=O
Tpsa:
26.3
Logp:
1.6357
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
1