CS-0361802
Methyl 3-(N-(2-chloro-4-methylphenyl)sulfamoyl)-4-fluorobenzo[b]thiophene-2-carboxylate
Manufacturer: ChemScene
CAS Number: 941919-15-9
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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
C₁₇H₁₃ClFNO₄S₂
Molecular Weight
413.87
Synonyms
Benzo[b]thiophene-2-carboxylic acid, 3-[[(2-chloro-4-methylphenyl)amino]sulfonyl]-4-fluoro-, methyl ester
SMILES
CC1=CC(=C(C=C1)NS(=O)(=O)C2=C(C(=O)OC)SC3=CC=CC(=C32)F)Cl
Tpsa
72.47
Logp
4.58962
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: C₁₇H₁₃ClFNO₄S₂
Molecular Weight: 413.87
Synonyms: Benzo[b]thiophene-2-carboxylic acid, 3-[[(2-chloro-4-methylphenyl)amino]sulfonyl]-4-fluoro-, methyl ester
SMILES: CC1=CC(=C(C=C1)NS(=O)(=O)C2=C(C(=O)OC)SC3=CC=CC(=C32)F)Cl
Tpsa: 72.47
Logp: 4.58962
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:
C₁₇H₁₃ClFNO₄S₂
Molecular Weight:
413.87
Synonyms:
Benzo[b]thiophene-2-carboxylic acid, 3-[[(2-chloro-4-methylphenyl)amino]sulfonyl]-4-fluoro-, methyl ester
SMILES:
CC1=CC(=C(C=C1)NS(=O)(=O)C2=C(C(=O)OC)SC3=CC=CC(=C32)F)Cl
Tpsa:
72.47
Logp:
4.58962
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: C₁₈H₁₆FNO₆S₂
Molecular Weight: 425.45
Synonyms: SZDZVBAUQZAELV-UHFFFAOYSA-N
SMILES: O=C(C1=C(S(=O)(NC2=CC=C(OC)C(OC)=C2)=O)C3=C(F)C=CC=C3S1)OC
Tpsa: 90.93
Logp: 3.645
H Acceptors: 7
H Donors: 1
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₁₆FNO₆S₂
Molecular Weight:
425.45
Synonyms:
SZDZVBAUQZAELV-UHFFFAOYSA-N
SMILES:
O=C(C1=C(S(=O)(NC2=CC=C(OC)C(OC)=C2)=O)C3=C(F)C=CC=C3S1)OC
Tpsa:
90.93
Logp:
3.645
H Acceptors:
7
H Donors:
1
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₀ClF₂NO₄S₂
Molecular Weight: 417.83
Synonyms: IYGZXHNHLFMVQL-UHFFFAOYSA-N
SMILES: O=C(C1=C(S(=O)(NC2=CC=C(F)C(Cl)=C2)=O)C3=C(F)C=CC=C3S1)OC
Tpsa: 72.47
Logp: 4.4203
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:
C₁₆H₁₀ClF₂NO₄S₂
Molecular Weight:
417.83
Synonyms:
IYGZXHNHLFMVQL-UHFFFAOYSA-N
SMILES:
O=C(C1=C(S(=O)(NC2=CC=C(F)C(Cl)=C2)=O)C3=C(F)C=CC=C3S1)OC
Tpsa:
72.47
Logp:
4.4203
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: C₁₇H₁₃ClFNO₅S₂
Molecular Weight: 429.87
Synonyms: NXTUUVIZUDTJDO-UHFFFAOYSA-N
SMILES: O=C(C1=C(S(=O)(NC2=CC=C(OC)C(Cl)=C2)=O)C3=C(F)C=CC=C3S1)OC
Tpsa: 81.7
Logp: 4.2898
H Acceptors: 6
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:
C₁₇H₁₃ClFNO₅S₂
Molecular Weight:
429.87
Synonyms:
NXTUUVIZUDTJDO-UHFFFAOYSA-N
SMILES:
O=C(C1=C(S(=O)(NC2=CC=C(OC)C(Cl)=C2)=O)C3=C(F)C=CC=C3S1)OC
Tpsa:
81.7
Logp:
4.2898
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
5