9K-303S
TL;DR: 9K-303S (CAS 956193-89-8) is a chemical compound with molecular formula C22H15Cl2F3N4OS and molecular weight 510.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]-N-[(4-methylphenyl)methyl]-5-(trifluoromethyl)pyrazole-4-carboxamide
Also Known As: 9K-303S, 1-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]-N-(4-methylbenzyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxamide, 1-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]-N-[(4-methylphenyl)methyl]-5-(trifluoromethyl)pyrazole-4-carboxamide, 1-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]-N-[(4-methylphenyl)methyl]-5-(trifluoromethyl)-1H-pyrazole-4-carboxamide
| Molecular Formula | C22H15Cl2F3N4OS |
|---|---|
| Molecular Weight | 510.03 g/mol |
| LogP | 6.55982 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 510.02957 |
| Heavy Atoms | 33 |
| Complexity | 1316.1748 |
Chemical Identifiers
| CAS Number | 956193-89-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CNC(=O)C2=C(N(N=C2)C3=NC(=CS3)C4=CC(=C(C=C4)Cl)Cl)C(F)(F)F |
Product Overview
9K-303S (CAS 956193-89-8), with molecular formula C22H15Cl2F3N4OS and molecular weight 510.03 g/mol. IUPAC: 1-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]-N-[(4-methylphenyl)methyl]-5-(trifluoromethyl)pyrazole-4-carboxamide.
Chemical Property Profile of 9K-303S
Property Insights of 9K-303S
The XLogP value of 6.55982 indicates that 9K-303S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.81 Ų, 9K-303S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9K-303S has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 9K-303S?
The CAS number of 9K-303S is 956193-89-8.
What is the molecular formula of 9K-303S?
The molecular formula of 9K-303S is C22H15Cl2F3N4OS.
What is the molecular weight of 9K-303S?
The molecular weight of 9K-303S is 510.03 g/mol.
Where can I buy 9K-303S?
You can request a quote for 9K-303S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9K-303S?
Yes, KEHONG BIO provides custom synthesis services for 9K-303S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.