ChemDiv1_011378
TL;DR: ChemDiv1_011378 (CAS 312507-38-3) is a chemical compound with molecular formula C22H22F2N2O5 and molecular weight 432.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-[4-(difluoromethoxy)-3-methoxyphenyl]-3-methyl-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylate
Also Known As: ChemDiv1_011378, ethyl 4-[4-(difluoromethoxy)-3-methoxyphenyl]-1-methyl-2-oxo-6-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate, A1928/0081127, ethyl 6-[4-(difluoromethoxy)-3-methoxyphenyl]-3-methyl-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylate, ethyl 4-(4-(difluoromethoxy)-3-methoxyphenyl)-1-methyl-2-oxo-6-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
| Molecular Formula | C22H22F2N2O5 |
|---|---|
| Molecular Weight | 432.15 g/mol |
| LogP | 3.9671 |
| Topological Polar Surface Area | 77.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 432.1497 |
| Heavy Atoms | 31 |
| Complexity | 994.6507 |
Chemical Identifiers
| CAS Number | 312507-38-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(C(=O)NC1C2=CC(=C(C=C2)OC(F)F)OC)C)C3=CC=CC=C3 |
Product Overview
ChemDiv1_011378 (CAS 312507-38-3), with molecular formula C22H22F2N2O5 and molecular weight 432.15 g/mol. IUPAC: ethyl 6-[4-(difluoromethoxy)-3-methoxyphenyl]-3-methyl-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylate.
Chemical Property Profile of ChemDiv1_011378
Property Insights of ChemDiv1_011378
The XLogP value of 3.9671 indicates that ChemDiv1_011378 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.1 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_011378. Following Lipinski's Rule of Five, ChemDiv1_011378 has 1 hydrogen bond donor(s) and 5 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_011378?
The CAS number of ChemDiv1_011378 is 312507-38-3.
What is the molecular formula of ChemDiv1_011378?
The molecular formula of ChemDiv1_011378 is C22H22F2N2O5.
What is the molecular weight of ChemDiv1_011378?
The molecular weight of ChemDiv1_011378 is 432.15 g/mol.
Where can I buy ChemDiv1_011378?
You can request a quote for ChemDiv1_011378 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_011378?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_011378 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.