VU0613516-1
TL;DR: VU0613516-1 (CAS 903867-71-0) is a chemical compound with molecular formula C21H20N6O and molecular weight 372.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[[1-[(4-methylphenyl)methyl]pyrazolo[3,4-d]pyrimidin-4-yl]amino]phenyl]acetamide
Also Known As: VU0613516-1, F3379-0398, N-(4-((1-(4-methylbenzyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)amino)phenyl)acetamide, N-[4-({1-[(4-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-yl}amino)phenyl]acetamide, N-[4-[[1-[(4-methylphenyl)methyl]pyrazolo[3,4-d]pyrimidin-4-yl]amino]phenyl]acetamide
| Molecular Formula | C21H20N6O |
|---|---|
| Molecular Weight | 372.17 g/mol |
| LogP | 3.88502 |
| Topological Polar Surface Area | 84.73 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 372.16986 |
| Heavy Atoms | 28 |
| Complexity | 1116.067 |
Chemical Identifiers
| CAS Number | 903867-71-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN2C3=NC=NC(=C3C=N2)NC4=CC=C(C=C4)NC(=O)C |
Product Overview
VU0613516-1 (CAS 903867-71-0), with molecular formula C21H20N6O and molecular weight 372.17 g/mol. IUPAC: N-[4-[[1-[(4-methylphenyl)methyl]pyrazolo[3,4-d]pyrimidin-4-yl]amino]phenyl]acetamide.
Chemical Property Profile of VU0613516-1
Property Insights of VU0613516-1
The XLogP value of 3.88502 indicates that VU0613516-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.73 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0613516-1. Following Lipinski's Rule of Five, VU0613516-1 has 2 hydrogen bond donor(s) and 5 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 VU0613516-1?
The CAS number of VU0613516-1 is 903867-71-0.
What is the molecular formula of VU0613516-1?
The molecular formula of VU0613516-1 is C21H20N6O.
What is the molecular weight of VU0613516-1?
The molecular weight of VU0613516-1 is 372.17 g/mol.
Where can I buy VU0613516-1?
You can request a quote for VU0613516-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0613516-1?
Yes, KEHONG BIO provides custom synthesis services for VU0613516-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.