VU0496845-1
TL;DR: VU0496845-1 (CAS 899746-65-7) is a chemical compound with molecular formula C18H15ClFN5O and molecular weight 371.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-(2-cyanoethyl)-1-(4-fluorophenyl)-N,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide
Also Known As: VU0496845-1, F2759-0401, 4-chloro-N-(2-cyanoethyl)-1-(4-fluorophenyl)-N,3-dimethyl-1H-pyrazolo[3,4-b]pyridine-5-carboxamide, 4-chloro-N-(2-cyanoethyl)-1-(4-fluorophenyl)-N,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide
| Molecular Formula | C18H15ClFN5O |
|---|---|
| Molecular Weight | 371.09 g/mol |
| LogP | 3.5071 |
| Topological Polar Surface Area | 74.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 371.0949 |
| Heavy Atoms | 26 |
| Complexity | 1022.72284 |
Chemical Identifiers
| CAS Number | 899746-65-7 |
|---|---|
| SMILES | CC1=NN(C2=NC=C(C(=C12)Cl)C(=O)N(C)CCC#N)C3=CC=C(C=C3)F |
Product Overview
VU0496845-1 (CAS 899746-65-7), with molecular formula C18H15ClFN5O and molecular weight 371.09 g/mol. IUPAC: 4-chloro-N-(2-cyanoethyl)-1-(4-fluorophenyl)-N,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide.
Chemical Property Profile of VU0496845-1
Property Insights of VU0496845-1
The XLogP value of 3.5071 indicates that VU0496845-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.81 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0496845-1. Following Lipinski's Rule of Five, VU0496845-1 has 0 hydrogen bond donor(s) and 4 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 VU0496845-1?
The CAS number of VU0496845-1 is 899746-65-7.
What is the molecular formula of VU0496845-1?
The molecular formula of VU0496845-1 is C18H15ClFN5O.
What is the molecular weight of VU0496845-1?
The molecular weight of VU0496845-1 is 371.09 g/mol.
Where can I buy VU0496845-1?
You can request a quote for VU0496845-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0496845-1?
Yes, KEHONG BIO provides custom synthesis services for VU0496845-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.