CS-0545268
Methyl 3-(N-(3,5-dimethylphenyl)sulfamoyl)-4-fluorobenzo[b]thiophene-2-carboxylate
Manufacturer: ChemScene
CAS Number: 932464-81-8
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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
C₁₈H₁₆FNO₄S₂
Molecular Weight
393.45
Synonyms
methyl 3-{[(3,5-dimethylphenyl)amino]sulfonyl}-4-fluoro-1-benzothiophene-2-carboxylate
SMILES
CC1=CC(=CC(=C1)NS(=O)(=O)C2=C(SC3=CC=CC(=C32)F)C(=O)OC)C
Tpsa
72.47
Logp
4.24464
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: C₁₈H₁₆FNO₄S₂
Molecular Weight: 393.45
Synonyms: methyl 3-{[(3,5-dimethylphenyl)amino]sulfonyl}-4-fluoro-1-benzothiophene-2-carboxylate
SMILES: CC1=CC(=CC(=C1)NS(=O)(=O)C2=C(SC3=CC=CC(=C32)F)C(=O)OC)C
Tpsa: 72.47
Logp: 4.24464
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:
C₁₈H₁₆FNO₄S₂
Molecular Weight:
393.45
Synonyms:
methyl 3-{[(3,5-dimethylphenyl)amino]sulfonyl}-4-fluoro-1-benzothiophene-2-carboxylate
SMILES:
CC1=CC(=CC(=C1)NS(=O)(=O)C2=C(SC3=CC=CC(=C32)F)C(=O)OC)C
Tpsa:
72.47
Logp:
4.24464
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: C₁₈H₁₇NO₄S₂
Molecular Weight: 375.46
Synonyms: CVYHKGJNBIZYIA-UHFFFAOYSA-N
SMILES: CCOC(=O)C1=C(C2=CC=CC=C2S1)S(=O)(=O)NC3=CC=CC(=C3)C
Tpsa: 72.47
Logp: 4.18722
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₁₇NO₄S₂
Molecular Weight:
375.46
Synonyms:
CVYHKGJNBIZYIA-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1=C(C2=CC=CC=C2S1)S(=O)(=O)NC3=CC=CC(=C3)C
Tpsa:
72.47
Logp:
4.18722
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₂N₂
Molecular Weight: 184.24
Synonyms: 7-methyl-1H,2H,3H-pyrrolo[2,3-b]quinoline
SMILES: CC1=CC2=NC3=C(CCN3)C=C2C=C1
Tpsa: 24.92
Logp: 2.51122
H Acceptors: 2
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:
C₁₂H₁₂N₂
Molecular Weight:
184.24
Synonyms:
7-methyl-1H,2H,3H-pyrrolo[2,3-b]quinoline
SMILES:
CC1=CC2=NC3=C(CCN3)C=C2C=C1
Tpsa:
24.92
Logp:
2.51122
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₁N₃O₂
Molecular Weight: 217.22
Synonyms: None
SMILES: CN(CC(=O)O)C1=NC=NC2=CC=CC=C21
Tpsa: 66.32
Logp: 1.1506
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₁N₃O₂
Molecular Weight:
217.22
Synonyms:
None
SMILES:
CN(CC(=O)O)C1=NC=NC2=CC=CC=C21
Tpsa:
66.32
Logp:
1.1506
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3