F2031-0958
TL;DR: F2031-0958 (CAS 896009-02-2) 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.
2-[[6-[4-(3-chlorophenyl)piperazin-1-yl]-1-methylpyrazolo[3,4-d]pyrimidin-4-yl]amino]ethanol
Also Known As: F2031-0958, 2-((6-(4-(3-chlorophenyl)piperazin-1-yl)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)amino)ethanol, 2-[[6-[4-(3-chlorophenyl)piperazin-1-yl]-1-methylpyrazolo[3,4-d]pyrimidin-4-yl]amino]ethanol, 2-({6-[4-(3-chlorophenyl)piperazin-1-yl]-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}amino)ethanol, 2-{6-[4-(m-chlorophenyl)-1-piperazinyl]-1-methyl-1,2,5,7-tetraaza-1H-inden-4-ylamino}ethanol
| Molecular Formula | C18H22ClN7O |
|---|---|
| Molecular Weight | 387.16 g/mol |
| LogP | 1.7475 |
| Topological Polar Surface Area | 82.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 387.15744 |
| Heavy Atoms | 27 |
| Complexity | 936.60486 |
Chemical Identifiers
| CAS Number | 896009-02-2 |
|---|---|
| SMILES | CN1C2=NC(=NC(=C2C=N1)NCCO)N3CCN(CC3)C4=CC(=CC=C4)Cl |
Product Overview
F2031-0958 (CAS 896009-02-2), with molecular formula C18H22ClN7O and molecular weight 387.16 g/mol. IUPAC: 2-[[6-[4-(3-chlorophenyl)piperazin-1-yl]-1-methylpyrazolo[3,4-d]pyrimidin-4-yl]amino]ethanol.
Chemical Property Profile of F2031-0958
Property Insights of F2031-0958
The XLogP value of 1.7475 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F2031-0958. The TPSA of 82.34 Ų falls within the moderate polarity range, balancing permeability and solubility for F2031-0958. Following Lipinski's Rule of Five, F2031-0958 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 F2031-0958?
The CAS number of F2031-0958 is 896009-02-2.
What is the molecular formula of F2031-0958?
The molecular formula of F2031-0958 is C18H22ClN7O.
What is the molecular weight of F2031-0958?
The molecular weight of F2031-0958 is 387.16 g/mol.
Where can I buy F2031-0958?
You can request a quote for F2031-0958 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2031-0958?
Yes, KEHONG BIO provides custom synthesis services for F2031-0958 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.