CS-0574821
4-(3-(3-(5-Bromo-2-methoxyphenyl)acryloyl)thioureido)benzoic acid
Manufacturer: ChemScene
CAS Number: 535936-56-2
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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
C₁₈H₁₅BrN₂O₄S
Molecular Weight
435.29
Synonyms
4-[3-(5-Bromo-2-methoxyphenyl)prop-2-enoylcarbamothioylamino]benzoic acid
SMILES
COC1=C(C=C(C=C1)Br)C=CC(=O)NC(=S)NC2=CC=C(C=C2)C(=O)O
Tpsa
87.66
Logp
3.6823
H Acceptors
4
H Donors
3
Rotatable Bonds
5
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 535936-56-2 | 4-[[[[3-(5-BROMO-2-METHOXYPHENYL)-1-OXO-2-PROPENYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID | A2B Chem | -- |
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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: C₁₈H₁₅BrN₂O₄S
Molecular Weight: 435.29
Synonyms: 4-[3-(5-Bromo-2-methoxyphenyl)prop-2-enoylcarbamothioylamino]benzoic acid
SMILES: COC1=C(C=C(C=C1)Br)C=CC(=O)NC(=S)NC2=CC=C(C=C2)C(=O)O
Tpsa: 87.66
Logp: 3.6823
H Acceptors: 4
H Donors: 3
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:
C₁₈H₁₅BrN₂O₄S
Molecular Weight:
435.29
Synonyms:
4-[3-(5-Bromo-2-methoxyphenyl)prop-2-enoylcarbamothioylamino]benzoic acid
SMILES:
COC1=C(C=C(C=C1)Br)C=CC(=O)NC(=S)NC2=CC=C(C=C2)C(=O)O
Tpsa:
87.66
Logp:
3.6823
H Acceptors:
4
H Donors:
3
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: C₉H₈N₂O₂
Molecular Weight: 176.17
Synonyms: 3-(4-Nitrophenyl)propionitrile
SMILES: C1=CC(=CC=C1CCC#N)[N+](=O)[O-]
Tpsa: 66.93
Logp: 2.05098
H Acceptors: 3
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:
C₉H₈N₂O₂
Molecular Weight:
176.17
Synonyms:
3-(4-Nitrophenyl)propionitrile
SMILES:
C1=CC(=CC=C1CCC#N)[N+](=O)[O-]
Tpsa:
66.93
Logp:
2.05098
H Acceptors:
3
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: C₁₂H₂₀N₄O₄S
Molecular Weight: 316.38
Synonyms: None
SMILES: C1CN(CCN1CC2=CC=CC=C2)C(=N)N.OS(=O)(=O)O
Tpsa: 130.95
Logp: 0.04487
H Acceptors: 4
H Donors: 4
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:
C₁₂H₂₀N₄O₄S
Molecular Weight:
316.38
Synonyms:
None
SMILES:
C1CN(CCN1CC2=CC=CC=C2)C(=N)N.OS(=O)(=O)O
Tpsa:
130.95
Logp:
0.04487
H Acceptors:
4
H Donors:
4
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: C₁₂H₁₁F₃O
Molecular Weight: 228.21
Synonyms: Cyclobutyl 4-trifluoromethylphenyl ketone
SMILES: C1CC(C1)C(=O)C2=CC=C(C=C2)C(F)(F)F
Tpsa: 17.07
Logp: 3.6882
H Acceptors: 1
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:
C₁₂H₁₁F₃O
Molecular Weight:
228.21
Synonyms:
Cyclobutyl 4-trifluoromethylphenyl ketone
SMILES:
C1CC(C1)C(=O)C2=CC=C(C=C2)C(F)(F)F
Tpsa:
17.07
Logp:
3.6882
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
2