BAS 09530667
TL;DR: BAS 09530667 (CAS 445229-84-5) is a chemical compound with molecular formula C22H16F2N4O3 and molecular weight 422.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-yl)-7-(difluoromethyl)-5-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
Also Known As: BAS 09530667, N-(1,3-benzodioxol-5-yl)-7-(difluoromethyl)-5-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide, N~3~-(1,3-BENZODIOXOL-5-YL)-7-(DIFLUOROMETHYL)-5-(4-METHYLPHENYL)PYRAZOLO[1,5-A]PYRIMIDINE-3-CARBOXAMIDE
| Molecular Formula | C22H16F2N4O3 |
|---|---|
| Molecular Weight | 422.12 g/mol |
| LogP | 4.62332 |
| Topological Polar Surface Area | 77.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 422.11905 |
| Heavy Atoms | 31 |
| Complexity | 1302.3575 |
Chemical Identifiers
| CAS Number | 445229-84-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NC3=C(C=NN3C(=C2)C(F)F)C(=O)NC4=CC5=C(C=C4)OCO5 |
Product Overview
BAS 09530667 (CAS 445229-84-5), with molecular formula C22H16F2N4O3 and molecular weight 422.12 g/mol. IUPAC: N-(1,3-benzodioxol-5-yl)-7-(difluoromethyl)-5-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.
Chemical Property Profile of BAS 09530667
Property Insights of BAS 09530667
The XLogP value of 4.62332 indicates that BAS 09530667 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.75 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 09530667. Following Lipinski's Rule of Five, BAS 09530667 has 1 hydrogen bond donor(s) and 5 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 09530667?
The CAS number of BAS 09530667 is 445229-84-5.
What is the molecular formula of BAS 09530667?
The molecular formula of BAS 09530667 is C22H16F2N4O3.
What is the molecular weight of BAS 09530667?
The molecular weight of BAS 09530667 is 422.12 g/mol.
Where can I buy BAS 09530667?
You can request a quote for BAS 09530667 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 09530667?
Yes, KEHONG BIO provides custom synthesis services for BAS 09530667 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.