ML314 Analog
TL;DR: ML314 Analog (CAS 1052519-84-2) is a chemical compound with molecular formula C22H23ClN4O2 and molecular weight 410.15094 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[4-(2-methoxyphenyl)piperazin-1-yl]-2-methyl-[1]benzofuro[3,2-d]pyrimidine;hydrochloride
Also Known As: ML314 Analog, 4-(4-(2-methoxyphenyl)piperazin-1-yl)-2-methylbenzofuro[3,2-d]pyrimidine hydrochloride, 4-[4-(2-methoxyphenyl)piperazin-1-yl]-2-methyl-[1]benzofuro[3,2-d]pyrimidine hydrochloride, REGID_for_CID_6602823
Technical Specifications
| Molecular Formula | C22H23ClN4O2 |
| Molecular Weight | 410.15094 g/mol |
| XLogP | 4.44142 |
| Topological Polar Surface Area (TPSA) | 54.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 410.15094 Da |
| Heavy Atoms | 29 |
| Complexity | 527.0 |
| SMILES | CC1=NC2=C(C(=N1)N3CCN(CC3)C4=CC=CC=C4OC)OC5=CC=CC=C52.Cl |
| InChIKey | QVSDJHAWEMNNKT-UHFFFAOYSA-N |
Chemical Property Profile of ML314 Analog
Property Insights of ML314 Analog
The XLogP value of 4.44142 indicates that ML314 Analog is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.6 Ų, ML314 Analog exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ML314 Analog has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of ML314 Analog?
The CAS number of ML314 Analog is 1052519-84-2.
What is the molecular formula of ML314 Analog?
The molecular formula of ML314 Analog is C22H23ClN4O2.
What is the molecular weight of ML314 Analog?
The molecular weight of ML314 Analog is 410.15094 g/mol.
Where can I buy ML314 Analog?
You can request a quote for ML314 Analog directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for ML314 Analog?
Yes, CoreyChem provides custom synthesis services for ML314 Analog and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.