CS-0325777
4-((5-Butyramido-2-chlorophenyl)amino)-4-oxobutanoic acid
Manufacturer: ChemScene
CAS Number: 925180-36-5
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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
C₁₄H₁₇ClN₂O₄
Molecular Weight
312.75
Synonyms
None
SMILES
CCCC(NC1=CC(NC(CCC(O)=O)=O)=C(Cl)C=C1)=O
Tpsa
95.5
Logp
2.8819
H Acceptors
3
H Donors
3
Rotatable Bonds
7
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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-P330-P362+P364-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: C₁₄H₁₇ClN₂O₄
Molecular Weight: 312.75
Synonyms: None
SMILES: CCCC(NC1=CC(NC(CCC(O)=O)=O)=C(Cl)C=C1)=O
Tpsa: 95.5
Logp: 2.8819
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₇ClN₂O₄
Molecular Weight:
312.75
Synonyms:
None
SMILES:
CCCC(NC1=CC(NC(CCC(O)=O)=O)=C(Cl)C=C1)=O
Tpsa:
95.5
Logp:
2.8819
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
7
Purity: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₂₂FN₃O₃
Molecular Weight: 323.36
Synonyms: β-Alanine, N-[[4-(2-fluorophenyl)-1-piperazinyl]carbonyl]-, ethyl ester
SMILES: O=C(OCC)CCNC(N1CCN(C2=CC=CC=C2F)CC1)=O
Tpsa: 61.88
Logp: 1.6105
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 5
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₂₂FN₃O₃
Molecular Weight:
323.36
Synonyms:
β-Alanine, N-[[4-(2-fluorophenyl)-1-piperazinyl]carbonyl]-, ethyl ester
SMILES:
O=C(OCC)CCNC(N1CCN(C2=CC=CC=C2F)CC1)=O
Tpsa:
61.88
Logp:
1.6105
H Acceptors:
4
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: C₁₅H₁₉NO₅
Molecular Weight: 293.32
Synonyms: 4-OXO-4-[2-(TETRAHYDRO-2-FURANYLMETHOXY)ANILINO]-BUTANOIC ACID
SMILES: O=C(O)CCC(NC1=CC=CC=C1OCC2CCCO2)=O
Tpsa: 84.86
Logp: 2.0477
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₁₉NO₅
Molecular Weight:
293.32
Synonyms:
4-OXO-4-[2-(TETRAHYDRO-2-FURANYLMETHOXY)ANILINO]-BUTANOIC ACID
SMILES:
O=C(O)CCC(NC1=CC=CC=C1OCC2CCCO2)=O
Tpsa:
84.86
Logp:
2.0477
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
7
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₁Cl₂NO₄
Molecular Weight: 292.12
Synonyms: methyl 5-chloro-3-{[(chloroacetyl)amino]methyl}-2-hydroxybenzoate
SMILES: O=C(OC)C1=CC(Cl)=CC(CNC(CCl)=O)=C1O
Tpsa: 75.63
Logp: 1.6872
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 4
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₁Cl₂NO₄
Molecular Weight:
292.12
Synonyms:
methyl 5-chloro-3-{[(chloroacetyl)amino]methyl}-2-hydroxybenzoate
SMILES:
O=C(OC)C1=CC(Cl)=CC(CNC(CCl)=O)=C1O
Tpsa:
75.63
Logp:
1.6872
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
4