CS-0555756
3-(5-Amino-3-(tert-butyl)-1H-pyrazol-1-yl)benzoic acid
Manufacturer: ChemScene
CAS Number: 725685-93-8
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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
C₁₄H₁₇N₃O₂
Molecular Weight
259.30
Synonyms
3-(5-amino-3-tert-butyl-pyrazol-1-yl)benzoic acid
SMILES
CC(C)(C)C1=NN(C(=C1)N)C2=CC=CC(=C2)C(=O)O
Tpsa
81.14
Logp
2.4502
H Acceptors
4
H Donors
2
Rotatable Bonds
2
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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: C₁₄H₁₇N₃O₂
Molecular Weight: 259.30
Synonyms: 3-(5-amino-3-tert-butyl-pyrazol-1-yl)benzoic acid
SMILES: CC(C)(C)C1=NN(C(=C1)N)C2=CC=CC(=C2)C(=O)O
Tpsa: 81.14
Logp: 2.4502
H Acceptors: 4
H Donors: 2
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:
C₁₄H₁₇N₃O₂
Molecular Weight:
259.30
Synonyms:
3-(5-amino-3-tert-butyl-pyrazol-1-yl)benzoic acid
SMILES:
CC(C)(C)C1=NN(C(=C1)N)C2=CC=CC(=C2)C(=O)O
Tpsa:
81.14
Logp:
2.4502
H Acceptors:
4
H Donors:
2
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: C₈H₉N₃O₂
Molecular Weight: 179.18
Synonyms: N'-acetylpyridine-3-carbohydrazide
SMILES: CC(=O)NNC(=O)C1=CN=CC=C1
Tpsa: 71.09
Logp: -0.1375
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₉N₃O₂
Molecular Weight:
179.18
Synonyms:
N'-acetylpyridine-3-carbohydrazide
SMILES:
CC(=O)NNC(=O)C1=CN=CC=C1
Tpsa:
71.09
Logp:
-0.1375
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₁₂F₃NO₂
Molecular Weight: 295.26
Synonyms: None
SMILES: COC1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)C(F)(F)F
Tpsa: 38.33
Logp: 3.9663
H Acceptors: 2
H Donors: 1
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:
C₁₅H₁₂F₃NO₂
Molecular Weight:
295.26
Synonyms:
None
SMILES:
COC1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)C(F)(F)F
Tpsa:
38.33
Logp:
3.9663
H Acceptors:
2
H Donors:
1
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: C₁₃H₁₇N₃O₂S
Molecular Weight: 279.36
Synonyms: 4-[(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)amino]butanoicacid
SMILES: CCC1=CC2=C(N=C(N=C2S1)C)NCCCC(=O)O
Tpsa: 75.11
Logp: 2.83882
H Acceptors: 5
H Donors: 2
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:
C₁₃H₁₇N₃O₂S
Molecular Weight:
279.36
Synonyms:
4-[(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)amino]butanoicacid
SMILES:
CCC1=CC2=C(N=C(N=C2S1)C)NCCCC(=O)O
Tpsa:
75.11
Logp:
2.83882
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
6