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BAS 00924508 structure
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BAS 00924508

TL;DR: BAS 00924508 (CAS 333765-12-1) is a chemical compound with molecular formula C18H16F3N5O3 and molecular weight 407.1205 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-tert-butyl-5-(4-nitrophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

Also Known As: BAS 00924508, N-tert-butyl-5-(4-nitrophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide, N-(tert-butyl)-5-(4-nitrophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide, N-(tert-butyl)[5-(4-nitrophenyl)-7-(trifluoromethyl)(8-hydropyrazolo[1,5-a]pyr imidin-2-yl)]carboxamide

CAS Number
333765-12-1
Molecular Formula
C18H16F3N5O3
Molecular Weight
407.1205 g/mol
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Technical Specifications

Molecular FormulaC18H16F3N5O3
Molecular Weight407.1205 g/mol
XLogP3.3
Topological Polar Surface Area (TPSA)105.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors8
Rotatable Bonds3
Exact Mass407.1205 Da
Heavy Atoms29
Complexity626.0
SMILESCC(C)(C)NC(=O)C1=NN2C(=CC(=NC2=C1)C3=CC=C(C=C3)[N+](=O)[O-])C(F)(F)F
InChIKeyIGEUBSOGJPKUGJ-UHFFFAOYSA-N

Chemical Property Profile of BAS 00924508

XLogP
3.3
TPSA (Topological Polar Surface Area)
105.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
8
Rotatable Bonds
3
Heavy Atoms
29
Complexity
626.0
Exact Mass
407.1205
Monoisotopic Mass
407.1205
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 BAS 00924508

The XLogP value of 3.3 indicates that BAS 00924508 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00924508. Following Lipinski's Rule of Five, BAS 00924508 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of BAS 00924508?

The CAS number of BAS 00924508 is 333765-12-1.

What is the molecular formula of BAS 00924508?

The molecular formula of BAS 00924508 is C18H16F3N5O3.

What is the molecular weight of BAS 00924508?

The molecular weight of BAS 00924508 is 407.1205 g/mol.

Where can I buy BAS 00924508?

You can request a quote for BAS 00924508 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for BAS 00924508?

Yes, CoreyChem provides custom synthesis services for BAS 00924508 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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