BAS 08302972
TL;DR: BAS 08302972 (CAS 489407-09-2) is a chemical compound with molecular formula C12H8Cl2F3N3O and molecular weight 337.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]-1-methylpyrazole-3-carboxamide
Also Known As: BAS 08302972, 4-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]-1-methyl-1H-pyrazole-3-carboxamide, 4-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]-1-methylpyrazole-3-carboxamide
| Molecular Formula | C12H8Cl2F3N3O |
|---|---|
| Molecular Weight | 337.00 g/mol |
| LogP | 3.998 |
| Topological Polar Surface Area | 46.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 336.99966 |
| Heavy Atoms | 21 |
| Complexity | 697.5415 |
Chemical Identifiers
| CAS Number | 489407-09-2 |
|---|---|
| SMILES | CN1C=C(C(=N1)C(=O)NC2=C(C=CC(=C2)C(F)(F)F)Cl)Cl |
Product Overview
BAS 08302972 (CAS 489407-09-2), with molecular formula C12H8Cl2F3N3O and molecular weight 337.00 g/mol. IUPAC: 4-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]-1-methylpyrazole-3-carboxamide.
Chemical Property Profile of BAS 08302972
Property Insights of BAS 08302972
The XLogP value of 3.998 indicates that BAS 08302972 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.92 Ų, BAS 08302972 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 08302972 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 08302972?
The CAS number of BAS 08302972 is 489407-09-2.
What is the molecular formula of BAS 08302972?
The molecular formula of BAS 08302972 is C12H8Cl2F3N3O.
What is the molecular weight of BAS 08302972?
The molecular weight of BAS 08302972 is 337.00 g/mol.
Where can I buy BAS 08302972?
You can request a quote for BAS 08302972 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 08302972?
Yes, KEHONG BIO provides custom synthesis services for BAS 08302972 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.