CS-0729383
2-((3-(4-Bromophenyl)-1H-1,2,4-triazol-5-yl)thio)-N-(o-tolyl)acetamide
Manufacturer: ChemScene
CAS Number: 332114-87-1
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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
C₁₇H₁₅BrN₄OS
Molecular Weight
403.30
Synonyms
None
SMILES
CC1=C(NC(=O)CSC2=NN=C(N2)C2=CC=C(Br)C=C2)C=CC=C1
Tpsa
70.67
Logp
4.27342
H Acceptors
4
H Donors
2
Rotatable Bonds
5
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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: C₁₇H₁₅BrN₄OS
Molecular Weight: 403.30
Synonyms: None
SMILES: CC1=C(NC(=O)CSC2=NN=C(N2)C2=CC=C(Br)C=C2)C=CC=C1
Tpsa: 70.67
Logp: 4.27342
H Acceptors: 4
H Donors: 2
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:
C₁₇H₁₅BrN₄OS
Molecular Weight:
403.30
Synonyms:
None
SMILES:
CC1=C(NC(=O)CSC2=NN=C(N2)C2=CC=C(Br)C=C2)C=CC=C1
Tpsa:
70.67
Logp:
4.27342
H Acceptors:
4
H Donors:
2
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: C₉H₁₀ClN₃O
Molecular Weight: 211.65
Synonyms: None
SMILES: COCC1=C(C#N)C(Cl)=NC(C)=C1N
Tpsa: 71.93
Logp: 1.6437
H Acceptors: 4
H Donors: 1
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:
C₉H₁₀ClN₃O
Molecular Weight:
211.65
Synonyms:
None
SMILES:
COCC1=C(C#N)C(Cl)=NC(C)=C1N
Tpsa:
71.93
Logp:
1.6437
H Acceptors:
4
H Donors:
1
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: C₁₃H₉NO₄
Molecular Weight: 243.21
Synonyms: None
SMILES: OC(=O)C1=CC(C2=CC=CC=C2)=C(C=N1)C(O)=O
Tpsa: 87.49
Logp: 2.145
H Acceptors: 3
H Donors: 2
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:
C₁₃H₉NO₄
Molecular Weight:
243.21
Synonyms:
None
SMILES:
OC(=O)C1=CC(C2=CC=CC=C2)=C(C=N1)C(O)=O
Tpsa:
87.49
Logp:
2.145
H Acceptors:
3
H Donors:
2
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: C₁₁H₁₁NO₂S
Molecular Weight: 221.28
Synonyms: None
SMILES: CC(SC1=CNC2=CC=CC=C12)C(O)=O
Tpsa: 53.09
Logp: 2.7331
H Acceptors: 2
H Donors: 2
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:
C₁₁H₁₁NO₂S
Molecular Weight:
221.28
Synonyms:
None
SMILES:
CC(SC1=CNC2=CC=CC=C12)C(O)=O
Tpsa:
53.09
Logp:
2.7331
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
3