AF-399/41702907
TL;DR: AF-399/41702907 (CAS 956502-30-0) is a chemical compound with molecular formula C25H25ClN4O5 and molecular weight 496.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxyethyl 4-[3-(3-chloro-4-methoxyphenyl)-1-phenylpyrazol-4-yl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: AF-399/41702907, 2-methoxyethyl 4-[3-(3-chloro-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, 2-methoxyethyl 4-[3-(3-chloro-4-methoxyphenyl)-1-phenylpyrazol-4-yl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
| Molecular Formula | C25H25ClN4O5 |
|---|---|
| Molecular Weight | 496.15 g/mol |
| LogP | 4.0188 |
| Topological Polar Surface Area | 103.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 496.15134 |
| Heavy Atoms | 35 |
| Complexity | 1272.1165 |
Chemical Identifiers
| CAS Number | 956502-30-0 |
|---|---|
| SMILES | CC1=C(C(NC(=O)N1)C2=CN(N=C2C3=CC(=C(C=C3)OC)Cl)C4=CC=CC=C4)C(=O)OCCOC |
Product Overview
AF-399/41702907 (CAS 956502-30-0), with molecular formula C25H25ClN4O5 and molecular weight 496.15 g/mol. IUPAC: 2-methoxyethyl 4-[3-(3-chloro-4-methoxyphenyl)-1-phenylpyrazol-4-yl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of AF-399/41702907
Property Insights of AF-399/41702907
The XLogP value of 4.0188 indicates that AF-399/41702907 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.71 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/41702907. Following Lipinski's Rule of Five, AF-399/41702907 has 2 hydrogen bond donor(s) and 6 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 AF-399/41702907?
The CAS number of AF-399/41702907 is 956502-30-0.
What is the molecular formula of AF-399/41702907?
The molecular formula of AF-399/41702907 is C25H25ClN4O5.
What is the molecular weight of AF-399/41702907?
The molecular weight of AF-399/41702907 is 496.15 g/mol.
Where can I buy AF-399/41702907?
You can request a quote for AF-399/41702907 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/41702907?
Yes, KEHONG BIO provides custom synthesis services for AF-399/41702907 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.