9K-317S
TL;DR: 9K-317S (CAS 321848-19-5) is a chemical compound with molecular formula C23H19F3N4O2S and molecular weight 472.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-N-[(4-methylphenyl)methyl]-5-(trifluoromethyl)pyrazole-4-carboxamide
Also Known As: 9K-317S, 1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-N-(4-methylbenzyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxamide, 1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-N-[(4-methylphenyl)methyl]-5-(trifluoromethyl)pyrazole-4-carboxamide, 1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-N-[(4-methylphenyl)methyl]-5-(trifluoromethyl)-1H-pyrazole-4-carboxamide
| Molecular Formula | C23H19F3N4O2S |
|---|---|
| Molecular Weight | 472.12 g/mol |
| LogP | 5.26162 |
| Topological Polar Surface Area | 69.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 472.11807 |
| Heavy Atoms | 33 |
| Complexity | 1262.3561 |
Chemical Identifiers
| CAS Number | 321848-19-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CNC(=O)C2=C(N(N=C2)C3=NC(=CS3)C4=CC=C(C=C4)OC)C(F)(F)F |
Product Overview
9K-317S (CAS 321848-19-5), with molecular formula C23H19F3N4O2S and molecular weight 472.12 g/mol. IUPAC: 1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-N-[(4-methylphenyl)methyl]-5-(trifluoromethyl)pyrazole-4-carboxamide.
Chemical Property Profile of 9K-317S
Property Insights of 9K-317S
The XLogP value of 5.26162 indicates that 9K-317S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.04 Ų falls within the moderate polarity range, balancing permeability and solubility for 9K-317S. Following Lipinski's Rule of Five, 9K-317S has 1 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 9K-317S?
The CAS number of 9K-317S is 321848-19-5.
What is the molecular formula of 9K-317S?
The molecular formula of 9K-317S is C23H19F3N4O2S.
What is the molecular weight of 9K-317S?
The molecular weight of 9K-317S is 472.12 g/mol.
Where can I buy 9K-317S?
You can request a quote for 9K-317S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9K-317S?
Yes, KEHONG BIO provides custom synthesis services for 9K-317S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.