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2-methyl-N-propyl-4-[[4-(2,2,2-trifluoroethoxymethyl)benzoyl]amino]pyrazole-3-carboxamide structure
Fine Chemical

2-methyl-N-propyl-4-[[4-(2,2,2-trifluoroethoxymethyl)benzoyl]amino]pyrazole-3-carboxamide

TL;DR: 2-methyl-N-propyl-4-[[4-(2,2,2-trifluoroethoxymethyl)benzoyl]amino]pyrazole-3-carboxamide (CAS 1005690-93-6) is a chemical compound with molecular formula C18H21F3N4O3 and molecular weight 398.1566 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-methyl-N-propyl-4-[[4-(2,2,2-trifluoroethoxymethyl)benzoyl]amino]pyrazole-5-carboxamide

Also Known As: 2-methyl-N-propyl-4-[[4-(2,2,2-trifluoroethoxymethyl)benzoyl]amino]pyrazole-3-carboxamide, 1-METHYL-N-PROPYL-4-({4-[(2,2,2-TRIFLUOROETHOXY)METHYL]BENZOYL}AMINO)-1H-PYRAZOLE-5-CARBOXAMIDE, 1-methyl-N-propyl-4-[({4-[(2,2,2-trifluoroethoxy)methyl]phenyl}carbonyl)amino]-1H-pyrazole-5-carboxamide

CAS Number
1005690-93-6
Molecular Formula
C18H21F3N4O3
Molecular Weight
398.1566 g/mol
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Technical Specifications

Molecular FormulaC18H21F3N4O3
Molecular Weight398.1566 g/mol
XLogP2.9
Topological Polar Surface Area (TPSA)85.3 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors7
Rotatable Bonds8
Exact Mass398.1566 Da
Heavy Atoms28
Complexity525.0
SMILESCCCNC(=O)C1=C(C=NN1C)NC(=O)C2=CC=C(C=C2)COCC(F)(F)F
InChIKeyAEXYNQZOAWELGW-UHFFFAOYSA-N

Chemical Property Profile of 2-methyl-N-propyl-4-[[4-(2,2,2-trifluoroethoxymethyl)benzoyl]amino]pyrazole-3-carboxamide

XLogP
2.9
TPSA (Topological Polar Surface Area)
85.3
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
7
Rotatable Bonds
8
Heavy Atoms
28
Complexity
525.0
Exact Mass
398.1566
Monoisotopic Mass
398.1566
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 2-methyl-N-propyl-4-[[4-(2,2,2-trifluoroethoxymethyl)benzoyl]amino]pyrazole-3-carboxamide

The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-methyl-N-propyl-4-[[4-(2,2,2-trifluoroethoxymethyl)benzoyl]amino]pyrazole-3-carboxamide. The TPSA of 85.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-methyl-N-propyl-4-[[4-(2,2,2-trifluoroethoxymethyl)benzoyl]amino]pyrazole-3-carboxamide. Following Lipinski's Rule of Five, 2-methyl-N-propyl-4-[[4-(2,2,2-trifluoroethoxymethyl)benzoyl]amino]pyrazole-3-carboxamide has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 2-methyl-N-propyl-4-[[4-(2,2,2-trifluoroethoxymethyl)benzoyl]amino]pyrazole-3-carboxamide?

The CAS number of 2-methyl-N-propyl-4-[[4-(2,2,2-trifluoroethoxymethyl)benzoyl]amino]pyrazole-3-carboxamide is 1005690-93-6.

What is the molecular formula of 2-methyl-N-propyl-4-[[4-(2,2,2-trifluoroethoxymethyl)benzoyl]amino]pyrazole-3-carboxamide?

The molecular formula of 2-methyl-N-propyl-4-[[4-(2,2,2-trifluoroethoxymethyl)benzoyl]amino]pyrazole-3-carboxamide is C18H21F3N4O3.

What is the molecular weight of 2-methyl-N-propyl-4-[[4-(2,2,2-trifluoroethoxymethyl)benzoyl]amino]pyrazole-3-carboxamide?

The molecular weight of 2-methyl-N-propyl-4-[[4-(2,2,2-trifluoroethoxymethyl)benzoyl]amino]pyrazole-3-carboxamide is 398.1566 g/mol.

Where can I buy 2-methyl-N-propyl-4-[[4-(2,2,2-trifluoroethoxymethyl)benzoyl]amino]pyrazole-3-carboxamide?

You can request a quote for 2-methyl-N-propyl-4-[[4-(2,2,2-trifluoroethoxymethyl)benzoyl]amino]pyrazole-3-carboxamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-methyl-N-propyl-4-[[4-(2,2,2-trifluoroethoxymethyl)benzoyl]amino]pyrazole-3-carboxamide?

Yes, CoreyChem provides custom synthesis services for 2-methyl-N-propyl-4-[[4-(2,2,2-trifluoroethoxymethyl)benzoyl]amino]pyrazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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