1L-650S
TL;DR: 1L-650S (CAS 400078-32-2) is a chemical compound with molecular formula C20H20N2O5 and molecular weight 368.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(4-hydroxy-3-methoxyphenyl)-6-oxo-2-phenyl-4,5-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: 1L-650S, ethyl 6-hydroxy-4-(4-hydroxy-3-methoxyphenyl)-2-phenyl-4,5-dihydro-5-pyrimidinecarboxylate, ethyl 4-(4-hydroxy-3-methoxyphenyl)-6-oxo-2-phenyl-4,5-dihydro-1H-pyrimidine-5-carboxylate, ethyl 6-hydroxy-4-(4-hydroxy-3-methoxyphenyl)-2-phenyl-4,5-dihydropyrimidine-5-carboxylate, ethyl6-hydroxy-4-(4-hydroxy-3-methoxyphenyl)-2-phenyl-4,5-dihydropyrimidine-5-carboxylate
| Molecular Formula | C20H20N2O5 |
|---|---|
| Molecular Weight | 368.14 g/mol |
| LogP | 2.1978 |
| Topological Polar Surface Area | 97.22 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 368.1372 |
| Heavy Atoms | 27 |
| Complexity | 879.19574 |
Chemical Identifiers
| CAS Number | 400078-32-2 |
|---|---|
| SMILES | CCOC(=O)C1C(N=C(NC1=O)C2=CC=CC=C2)C3=CC(=C(C=C3)O)OC |
Product Overview
1L-650S (CAS 400078-32-2), with molecular formula C20H20N2O5 and molecular weight 368.14 g/mol. IUPAC: ethyl 4-(4-hydroxy-3-methoxyphenyl)-6-oxo-2-phenyl-4,5-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of 1L-650S
Property Insights of 1L-650S
The XLogP value of 2.1978 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1L-650S. The TPSA of 97.22 Ų falls within the moderate polarity range, balancing permeability and solubility for 1L-650S. Following Lipinski's Rule of Five, 1L-650S 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 1L-650S?
The CAS number of 1L-650S is 400078-32-2.
What is the molecular formula of 1L-650S?
The molecular formula of 1L-650S is C20H20N2O5.
What is the molecular weight of 1L-650S?
The molecular weight of 1L-650S is 368.14 g/mol.
Where can I buy 1L-650S?
You can request a quote for 1L-650S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1L-650S?
Yes, KEHONG BIO provides custom synthesis services for 1L-650S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.