AS-871/41346100
TL;DR: AS-871/41346100 (CAS 537003-42-2) is a chemical compound with molecular formula C21H22N6O4 and molecular weight 422.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-N-pyridin-3-yl-7-(2,4,5-trimethoxyphenyl)-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Also Known As: AS-871/41346100, 5-METHYL-N-(PYRIDIN-3-YL)-7-(2,4,5-TRIMETHOXYPHENYL)-4H,7H-[1,2,4]TRIAZOLO[1,5-A]PYRIMIDINE-6-CARBOXAMIDE, F1214-0581, 5-methyl-N-(pyridin-3-yl)-7-(2,4,5-trimethoxyphenyl)-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide, 5-methyl-N-(3-pyridinyl)-7-(2,4,5-trimethoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
| Molecular Formula | C21H22N6O4 |
|---|---|
| Molecular Weight | 422.17 g/mol |
| LogP | 2.6265 |
| Topological Polar Surface Area | 112.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 422.17026 |
| Heavy Atoms | 31 |
| Complexity | 1142.0266 |
Chemical Identifiers
| CAS Number | 537003-42-2 |
|---|---|
| SMILES | CC1=C(C(N2C(=NC=N2)N1)C3=CC(=C(C=C3OC)OC)OC)C(=O)NC4=CN=CC=C4 |
Product Overview
AS-871/41346100 (CAS 537003-42-2), with molecular formula C21H22N6O4 and molecular weight 422.17 g/mol. IUPAC: 5-methyl-N-pyridin-3-yl-7-(2,4,5-trimethoxyphenyl)-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide.
Chemical Property Profile of AS-871/41346100
Property Insights of AS-871/41346100
The XLogP value of 2.6265 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AS-871/41346100. The TPSA of 112.42 Ų falls within the moderate polarity range, balancing permeability and solubility for AS-871/41346100. Following Lipinski's Rule of Five, AS-871/41346100 has 2 hydrogen bond donor(s) and 8 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 AS-871/41346100?
The CAS number of AS-871/41346100 is 537003-42-2.
What is the molecular formula of AS-871/41346100?
The molecular formula of AS-871/41346100 is C21H22N6O4.
What is the molecular weight of AS-871/41346100?
The molecular weight of AS-871/41346100 is 422.17 g/mol.
Where can I buy AS-871/41346100?
You can request a quote for AS-871/41346100 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AS-871/41346100?
Yes, KEHONG BIO provides custom synthesis services for AS-871/41346100 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.