CS-0561186
1-(1-(Methylsulfonyl)pyrrolidin-3-yl)-1H-pyrazole-4-carboxylic acid
Manufacturer: ChemScene
CAS Number: 1316225-68-9
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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
C₉H₁₃N₃O₄S
Molecular Weight
259.28
Synonyms
None
SMILES
CS(=O)(=O)N1CCC(C1)N2C=C(C=N2)C(=O)O
Tpsa
92.5
Logp
-0.2123
H Acceptors
5
H Donors
1
Rotatable Bonds
3
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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: C₉H₁₃N₃O₄S
Molecular Weight: 259.28
Synonyms: None
SMILES: CS(=O)(=O)N1CCC(C1)N2C=C(C=N2)C(=O)O
Tpsa: 92.5
Logp: -0.2123
H Acceptors: 5
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:
C₉H₁₃N₃O₄S
Molecular Weight:
259.28
Synonyms:
None
SMILES:
CS(=O)(=O)N1CCC(C1)N2C=C(C=N2)C(=O)O
Tpsa:
92.5
Logp:
-0.2123
H Acceptors:
5
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: C₁₀H₁₇N₃O
Molecular Weight: 195.26
Synonyms: None
SMILES: OC1=CC(=NN1C)C2(C)CCNCC2
Tpsa: 50.08
Logp: 0.7668
H Acceptors: 4
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:
C₁₀H₁₇N₃O
Molecular Weight:
195.26
Synonyms:
None
SMILES:
OC1=CC(=NN1C)C2(C)CCNCC2
Tpsa:
50.08
Logp:
0.7668
H Acceptors:
4
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: C₉H₁₉N₃O
Molecular Weight: 185.27
Synonyms: None
SMILES: O=C(NC)C1N(CCNC1)C(C)C
Tpsa: 44.37
Logp: -0.5854
H Acceptors: 3
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:
C₉H₁₉N₃O
Molecular Weight:
185.27
Synonyms:
None
SMILES:
O=C(NC)C1N(CCNC1)C(C)C
Tpsa:
44.37
Logp:
-0.5854
H Acceptors:
3
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: C₆H₈BrN₃
Molecular Weight: 202.05
Synonyms: (5-Bromo-6-methyl-pyrimidin-4-yl)-methyl-amine
SMILES: CC1=C(C(=NC=N1)NC)Br
Tpsa: 37.81
Logp: 1.58922
H Acceptors: 3
H Donors: 1
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:
C₆H₈BrN₃
Molecular Weight:
202.05
Synonyms:
(5-Bromo-6-methyl-pyrimidin-4-yl)-methyl-amine
SMILES:
CC1=C(C(=NC=N1)NC)Br
Tpsa:
37.81
Logp:
1.58922
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1