F2031-0436
TL;DR: F2031-0436 (CAS 887213-07-2) is a chemical compound with molecular formula C18H22ClN7O and molecular weight 387.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N-(4-chlorophenyl)-1-methyl-6-N-(2-morpholin-4-ylethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine
Also Known As: F2031-0436, 4-N-(4-chlorophenyl)-1-methyl-6-N-(2-morpholin-4-ylethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine, N4-(4-chlorophenyl)-1-methyl-N6-(2-morpholinoethyl)-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine, N4-(4-chlorophenyl)-1-methyl-N6-[2-(morpholin-4-yl)ethyl]-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine
| Molecular Formula | C18H22ClN7O |
|---|---|
| Molecular Weight | 387.16 g/mol |
| LogP | 2.5044 |
| Topological Polar Surface Area | 80.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 387.15744 |
| Heavy Atoms | 27 |
| Complexity | 905.9642 |
Chemical Identifiers
| CAS Number | 887213-07-2 |
|---|---|
| SMILES | CN1C2=NC(=NC(=C2C=N1)NC3=CC=C(C=C3)Cl)NCCN4CCOCC4 |
Product Overview
F2031-0436 (CAS 887213-07-2), with molecular formula C18H22ClN7O and molecular weight 387.16 g/mol. IUPAC: 4-N-(4-chlorophenyl)-1-methyl-6-N-(2-morpholin-4-ylethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine.
Chemical Property Profile of F2031-0436
Property Insights of F2031-0436
The XLogP value of 2.5044 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F2031-0436. The TPSA of 80.13 Ų falls within the moderate polarity range, balancing permeability and solubility for F2031-0436. Following Lipinski's Rule of Five, F2031-0436 has 2 hydrogen bond donor(s) and 7 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 F2031-0436?
The CAS number of F2031-0436 is 887213-07-2.
What is the molecular formula of F2031-0436?
The molecular formula of F2031-0436 is C18H22ClN7O.
What is the molecular weight of F2031-0436?
The molecular weight of F2031-0436 is 387.16 g/mol.
Where can I buy F2031-0436?
You can request a quote for F2031-0436 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2031-0436?
Yes, KEHONG BIO provides custom synthesis services for F2031-0436 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.