BAS 09530774
TL;DR: BAS 09530774 (CAS 445229-70-9) is a chemical compound with molecular formula C18H16F2N4O2 and molecular weight 358.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(difluoromethyl)-5-(4-methoxyphenyl)-N-prop-2-enylpyrazolo[1,5-a]pyrimidine-3-carboxamide
Also Known As: BAS 09530774, 7-(difluoromethyl)-5-(4-methoxyphenyl)-N-prop-2-enylpyrazolo[1,5-a]pyrimidine-3-carboxamide, N-allyl-7-(difluoromethyl)-5-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide, 7-(difluoromethyl)-5-(4-methoxyphenyl)-N-(prop-2-en-1-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
| Molecular Formula | C18H16F2N4O2 |
|---|---|
| Molecular Weight | 358.12 g/mol |
| LogP | 3.2583 |
| Topological Polar Surface Area | 68.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 358.12415 |
| Heavy Atoms | 26 |
| Complexity | 951.72955 |
Chemical Identifiers
| CAS Number | 445229-70-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NC3=C(C=NN3C(=C2)C(F)F)C(=O)NCC=C |
Product Overview
BAS 09530774 (CAS 445229-70-9), with molecular formula C18H16F2N4O2 and molecular weight 358.12 g/mol. IUPAC: 7-(difluoromethyl)-5-(4-methoxyphenyl)-N-prop-2-enylpyrazolo[1,5-a]pyrimidine-3-carboxamide.
Chemical Property Profile of BAS 09530774
Property Insights of BAS 09530774
The XLogP value of 3.2583 indicates that BAS 09530774 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.52 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 09530774. Following Lipinski's Rule of Five, BAS 09530774 has 1 hydrogen bond donor(s) and 4 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 09530774?
The CAS number of BAS 09530774 is 445229-70-9.
What is the molecular formula of BAS 09530774?
The molecular formula of BAS 09530774 is C18H16F2N4O2.
What is the molecular weight of BAS 09530774?
The molecular weight of BAS 09530774 is 358.12 g/mol.
Where can I buy BAS 09530774?
You can request a quote for BAS 09530774 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 09530774?
Yes, KEHONG BIO provides custom synthesis services for BAS 09530774 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.