BIM-0012389.P001
TL;DR: BIM-0012389.P001 (CAS 332854-29-2) is a chemical compound with molecular formula C22H21F3N4O2S and molecular weight 462.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-methoxyphenyl)-N-(2-methylsulfanylphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Also Known As: BIM-0012389.P001, 5-(4-methoxyphenyl)-N-[2-(methylsulfanyl)phenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide, 5-(4-methoxyphenyl)-N-(2-(methylthio)phenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide, 5-(4-methoxyphenyl)-N-(2-methylsulfanylphenyl)-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide, 5-(4-methoxyphenyl)-N-(2-methylsulfanylphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
| Molecular Formula | C22H21F3N4O2S |
|---|---|
| Molecular Weight | 462.13 g/mol |
| LogP | 5.5262 |
| Topological Polar Surface Area | 68.18 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 462.13373 |
| Heavy Atoms | 32 |
| Complexity | 1115.1089 |
Chemical Identifiers
| CAS Number | 332854-29-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2CC(N3C(=C(C=N3)C(=O)NC4=CC=CC=C4SC)N2)C(F)(F)F |
Product Overview
BIM-0012389.P001 (CAS 332854-29-2), with molecular formula C22H21F3N4O2S and molecular weight 462.13 g/mol. IUPAC: 5-(4-methoxyphenyl)-N-(2-methylsulfanylphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide.
Chemical Property Profile of BIM-0012389.P001
Property Insights of BIM-0012389.P001
The XLogP value of 5.5262 indicates that BIM-0012389.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.18 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0012389.P001. Following Lipinski's Rule of Five, BIM-0012389.P001 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BIM-0012389.P001?
The CAS number of BIM-0012389.P001 is 332854-29-2.
What is the molecular formula of BIM-0012389.P001?
The molecular formula of BIM-0012389.P001 is C22H21F3N4O2S.
What is the molecular weight of BIM-0012389.P001?
The molecular weight of BIM-0012389.P001 is 462.13 g/mol.
Where can I buy BIM-0012389.P001?
You can request a quote for BIM-0012389.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0012389.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0012389.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.