ChemDiv1_009991
TL;DR: ChemDiv1_009991 (CAS 438244-02-1) is a chemical compound with molecular formula C25H26N4O5 and molecular weight 462.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxyethyl 4-[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: ChemDiv1_009991, BAS 03353349, 2-methoxyethyl 4-[3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, 2-methoxyethyl 4-(3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, 2-methoxyethyl 4-[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
| Molecular Formula | C25H26N4O5 |
|---|---|
| Molecular Weight | 462.19 g/mol |
| LogP | 3.3654 |
| Topological Polar Surface Area | 103.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 462.1903 |
| Heavy Atoms | 34 |
| Complexity | 1201.8038 |
Chemical Identifiers
| CAS Number | 438244-02-1 |
|---|---|
| SMILES | CC1=C(C(NC(=O)N1)C2=CN(N=C2C3=CC=C(C=C3)OC)C4=CC=CC=C4)C(=O)OCCOC |
Product Overview
ChemDiv1_009991 (CAS 438244-02-1), with molecular formula C25H26N4O5 and molecular weight 462.19 g/mol. IUPAC: 2-methoxyethyl 4-[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of ChemDiv1_009991
Property Insights of ChemDiv1_009991
The XLogP value of 3.3654 indicates that ChemDiv1_009991 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 ChemDiv1_009991. Following Lipinski's Rule of Five, ChemDiv1_009991 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 ChemDiv1_009991?
The CAS number of ChemDiv1_009991 is 438244-02-1.
What is the molecular formula of ChemDiv1_009991?
The molecular formula of ChemDiv1_009991 is C25H26N4O5.
What is the molecular weight of ChemDiv1_009991?
The molecular weight of ChemDiv1_009991 is 462.19 g/mol.
Where can I buy ChemDiv1_009991?
You can request a quote for ChemDiv1_009991 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_009991?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_009991 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.