8R-0077
TL;DR: 8R-0077 (CAS 439111-91-8) is a chemical compound with molecular formula C25H24N4O2S and molecular weight 444.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(3,4-dimethoxyphenyl)-2-[3-(2,5-dimethylpyrrol-1-yl)thiophen-2-yl]-7-methylpyrazolo[1,5-a]pyrimidine
Also Known As: 8R-0077, 4-(2-[3-(2,5-DIMETHYL-1H-PYRROL-1-YL)-2-THIENYL]-7-METHYLPYRAZOLO[1,5-A]PYRIMIDIN-6-YL)-2-METHOXYPHENYL METHYL ETHER, 1-{2-[6-(3,4-dimethoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidin-2-yl]thiophen-3-yl}-2,5-dimethyl-1H-pyrrole, 6-(3,4-dimethoxyphenyl)-2-[3-(2,5-dimethylpyrrol-1-yl)thiophen-2-yl]-7-methylpyrazolo[1,5-a]pyrimidine, 4-{2-[3-(2,5-dimethyl-1H-pyrrol-1-yl)-2-thienyl]-7-methylpyrazolo[1,5-a]pyrimidin-6-yl}-2-methoxyphenyl methyl ether
| Molecular Formula | C25H24N4O2S |
|---|---|
| Molecular Weight | 444.16 g/mol |
| LogP | 5.85796 |
| Topological Polar Surface Area | 53.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 444.162 |
| Heavy Atoms | 32 |
| Complexity | 1424.458 |
Chemical Identifiers
| CAS Number | 439111-91-8 |
|---|---|
| SMILES | CC1=CC=C(N1C2=C(SC=C2)C3=NN4C(=C(C=NC4=C3)C5=CC(=C(C=C5)OC)OC)C)C |
Product Overview
8R-0077 (CAS 439111-91-8), with molecular formula C25H24N4O2S and molecular weight 444.16 g/mol. IUPAC: 6-(3,4-dimethoxyphenyl)-2-[3-(2,5-dimethylpyrrol-1-yl)thiophen-2-yl]-7-methylpyrazolo[1,5-a]pyrimidine.
Chemical Property Profile of 8R-0077
Property Insights of 8R-0077
The XLogP value of 5.85796 indicates that 8R-0077 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.58 Ų, 8R-0077 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8R-0077 has 0 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 8R-0077?
The CAS number of 8R-0077 is 439111-91-8.
What is the molecular formula of 8R-0077?
The molecular formula of 8R-0077 is C25H24N4O2S.
What is the molecular weight of 8R-0077?
The molecular weight of 8R-0077 is 444.16 g/mol.
Where can I buy 8R-0077?
You can request a quote for 8R-0077 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8R-0077?
Yes, KEHONG BIO provides custom synthesis services for 8R-0077 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.