Name: Name:1-Isopropyl-3-methyl-1h-pyrazole-4-carboxylic acid
Brand: AABLOCKS
SKU: AA008ZCZ
Rating: 90 (10 reviews)

Technical Information

Catalog Number: AA008ZCZ

Chemical Name: 1-Isopropyl-3-methyl-1h-pyrazole-4-carboxylic acid

CAS Number: 113100-42-8

Molecular Formula: C8H12N2O2

Molecular Weight: 168.1931

MDL Number: MFCD08700649

SMILES: OC(=O)c1cn(nc1C)C(C)C

Properties

Complexity: 182

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 12

Hydrogen Bond Acceptor Count: 3

Hydrogen Bond Donor Count: 1

Isotope Atom Count: 0

Rotatable Bond Count: 2

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 0.9

Downstream Synthesis Route

113100-42-8

18107-18-1

1127237-46-0

[1]CurrentPatentAssignee:BRISTOL-MYERSSQUIBBCO-WO2009/29384,2009,A2Locationinpatent:Page/Pagecolumn159

67-56-1

113100-42-8

18107-18-1

1127237-46-0

[1]CurrentPatentAssignee:BRISTOL-MYERSSQUIBBCO-WO2010/93359,2010,A1Locationinpatent:Page/Pagecolumn168-169

113100-42-8

6-(2-amino-5-chlorothiazol-4-yl)-3,4-dihydroquinolin-2(1H)-one

1-isopropyl-3-methyl-N-(4-(2-oxo-1,2,3,4-tetrahydroquinolin-6-yl)thiazol-2-yl)-1H-pyrazole-4-carboxamide

[1]CurrentPatentAssignee:NANTWORKSLLC-US2018/201610,2018,A1Locationinpatent:Paragraph0170;0171

113100-42-8

1-isopropyl-3-methyl-N-(4-(2-oxo-1-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydroquinolin-6-yl)thiazol-2-yl)-1H-pyrazole-4-carboxamide

[1]CurrentPatentAssignee:NANTWORKSLLC-US2018/201610,2018,A1

113100-42-8

1-isopropyl-3-methyl-N-(4-(2-oxo-1-(pyridin-2-ylmethyl)-1,2,3,4-tetrahydroquinolin-6-yl)thiazol-2-yl)-1H-pyrazole-4-carboxamide

[1]CurrentPatentAssignee:NANTWORKSLLC-US2018/201610,2018,A1

113100-42-8 | 1-Isopropyl-3-methyl-1h-pyrazole-4-carboxylic acid