BIM-0044440.P001
TL;DR: BIM-0044440.P001 (CAS 340300-22-3) is a chemical compound with molecular formula C22H20N2O6 and molecular weight 408.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[2-[(E)-[1-(4-methylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]phenoxy]acetate
Also Known As: BIM-0044440.P001, ethyl (2-{(E)-[1-(4-methylphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}phenoxy)acetate, (E)-ethyl 2-(2-((2,4,6-trioxo-1-(p-tolyl)tetrahydropyrimidin-5(2H)-ylidene)methyl)phenoxy)acetate, ethyl 2-[2-[(E)-[1-(4-methylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]phenoxy]acetate
| Molecular Formula | C22H20N2O6 |
|---|---|
| Molecular Weight | 408.13 g/mol |
| LogP | 2.60332 |
| Topological Polar Surface Area | 102.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 408.13214 |
| Heavy Atoms | 30 |
| Complexity | 1026.1782 |
Chemical Identifiers
| CAS Number | 340300-22-3 |
|---|---|
| SMILES | CCOC(=O)COC1=CC=CC=C1/C=C/2\C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)C |
Product Overview
BIM-0044440.P001 (CAS 340300-22-3), with molecular formula C22H20N2O6 and molecular weight 408.13 g/mol. IUPAC: ethyl 2-[2-[(E)-[1-(4-methylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]phenoxy]acetate.
Chemical Property Profile of BIM-0044440.P001
Property Insights of BIM-0044440.P001
The XLogP value of 2.60332 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BIM-0044440.P001. The TPSA of 102.01 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0044440.P001. Following Lipinski's Rule of Five, BIM-0044440.P001 has 1 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 BIM-0044440.P001?
The CAS number of BIM-0044440.P001 is 340300-22-3.
What is the molecular formula of BIM-0044440.P001?
The molecular formula of BIM-0044440.P001 is C22H20N2O6.
What is the molecular weight of BIM-0044440.P001?
The molecular weight of BIM-0044440.P001 is 408.13 g/mol.
Where can I buy BIM-0044440.P001?
You can request a quote for BIM-0044440.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0044440.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0044440.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.