AP-906/41637114
TL;DR: AP-906/41637114 (CAS 537698-94-5) is a chemical compound with molecular formula C23H24IN5O3 and molecular weight 545.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-hydroxypropyl)-N-(4-iodophenyl)-7-(3-methoxyphenyl)-5-methyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Also Known As: AP-906/41637114, 2-(3-hydroxypropyl)-N-(4-iodophenyl)-7-(3-methoxyphenyl)-5-methyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide, 2-(3-Hydroxypropyl)-N-(4-iodophenyl)-7-(3-methoxyphenyl)-5-methyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide, 2-(3-hydroxypropyl)-N-(4-iodophenyl)-7-(3-methoxyphenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
| Molecular Formula | C23H24IN5O3 |
|---|---|
| Molecular Weight | 545.09 g/mol |
| LogP | 3.7438 |
| Topological Polar Surface Area | 101.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 545.0924 |
| Heavy Atoms | 32 |
| Complexity | 1156.6935 |
Chemical Identifiers
| CAS Number | 537698-94-5 |
|---|---|
| SMILES | CC1=C(C(N2C(=NC(=N2)CCCO)N1)C3=CC(=CC=C3)OC)C(=O)NC4=CC=C(C=C4)I |
Product Overview
AP-906/41637114 (CAS 537698-94-5), with molecular formula C23H24IN5O3 and molecular weight 545.09 g/mol. IUPAC: 2-(3-hydroxypropyl)-N-(4-iodophenyl)-7-(3-methoxyphenyl)-5-methyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide.
Chemical Property Profile of AP-906/41637114
Property Insights of AP-906/41637114
The XLogP value of 3.7438 indicates that AP-906/41637114 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.3 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-906/41637114. Following Lipinski's Rule of Five, AP-906/41637114 has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AP-906/41637114?
The CAS number of AP-906/41637114 is 537698-94-5.
What is the molecular formula of AP-906/41637114?
The molecular formula of AP-906/41637114 is C23H24IN5O3.
What is the molecular weight of AP-906/41637114?
The molecular weight of AP-906/41637114 is 545.09 g/mol.
Where can I buy AP-906/41637114?
You can request a quote for AP-906/41637114 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-906/41637114?
Yes, KEHONG BIO provides custom synthesis services for AP-906/41637114 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.