CS-1068577
Methyl 4-(6-fluoro-4-oxo-2-thioxo-1,4-dihydroquinazolin-3(2H)-yl)butanoate
Manufacturer: ChemScene
CAS Number: 2853465-59-3
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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
C₁₃H₁₃FN₂O₃S
Molecular Weight
296.32
Synonyms
None
SMILES
O=C(OC)CCCN1C(=O)C2=CC(F)=CC=C2NC1=S
Tpsa
64.09
Logp
2.15139
H Acceptors
5
H Donors
1
Rotatable Bonds
4
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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: C₁₃H₁₃FN₂O₃S
Molecular Weight: 296.32
Synonyms: None
SMILES: O=C(OC)CCCN1C(=O)C2=CC(F)=CC=C2NC1=S
Tpsa: 64.09
Logp: 2.15139
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:
C₁₃H₁₃FN₂O₃S
Molecular Weight:
296.32
Synonyms:
None
SMILES:
O=C(OC)CCCN1C(=O)C2=CC(F)=CC=C2NC1=S
Tpsa:
64.09
Logp:
2.15139
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: C₈H₁₅N
Molecular Weight: 125.21
Synonyms: None
SMILES: C[C@]12[C@](C[C@@H](N)C1)(CC2)[H]
Tpsa: 26.02
Logp: 1.5238
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:
C₈H₁₅N
Molecular Weight:
125.21
Synonyms:
None
SMILES:
C[C@]12[C@](C[C@@H](N)C1)(CC2)[H]
Tpsa:
26.02
Logp:
1.5238
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: C₉H₅Cl₂N
Molecular Weight: 198.05
Synonyms: None
SMILES: ClC1=CN=CC=2C=CC=C(Cl)C12
Tpsa: 12.89
Logp: 3.5416
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:
C₉H₅Cl₂N
Molecular Weight:
198.05
Synonyms:
None
SMILES:
ClC1=CN=CC=2C=CC=C(Cl)C12
Tpsa:
12.89
Logp:
3.5416
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: C₁₅H₁₇BrN₂O
Molecular Weight: 321.21
Synonyms: None
SMILES: BrC=1C=2C=NN(C2C=C(C1C=C)C)C3OCCCC3
Tpsa: 27.05
Logp: 4.44932
H Acceptors: 3
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:
C₁₅H₁₇BrN₂O
Molecular Weight:
321.21
Synonyms:
None
SMILES:
BrC=1C=2C=NN(C2C=C(C1C=C)C)C3OCCCC3
Tpsa:
27.05
Logp:
4.44932
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
2