VU0499897-1
TL;DR: VU0499897-1 (CAS 1001502-66-4) is a chemical compound with molecular formula C18H18ClN7O2 and molecular weight 399.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(3-chlorophenyl)piperazin-1-yl]-6-methyl-2-(4-nitropyrazol-1-yl)pyrimidine
Also Known As: VU0499897-1, 4-[4-(3-chlorophenyl)piperazin-1-yl]-6-methyl-2-(4-nitro-1H-pyrazol-1-yl)pyrimidine, F2803-0182, 4-[4-(3-chlorophenyl)piperazin-1-yl]-6-methyl-2-(4-nitropyrazol-1-yl)pyrimidine, 4-(4-(3-chlorophenyl)piperazin-1-yl)-6-methyl-2-(4-nitro-1H-pyrazol-1-yl)pyrimidine
| Molecular Formula | C18H18ClN7O2 |
|---|---|
| Molecular Weight | 399.12 g/mol |
| LogP | 2.85892 |
| Topological Polar Surface Area | 93.22 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 399.12106 |
| Heavy Atoms | 28 |
| Complexity | 1014.67365 |
Chemical Identifiers
| CAS Number | 1001502-66-4 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)N2C=C(C=N2)[N+](=O)[O-])N3CCN(CC3)C4=CC(=CC=C4)Cl |
Product Overview
VU0499897-1 (CAS 1001502-66-4), with molecular formula C18H18ClN7O2 and molecular weight 399.12 g/mol. IUPAC: 4-[4-(3-chlorophenyl)piperazin-1-yl]-6-methyl-2-(4-nitropyrazol-1-yl)pyrimidine.
Chemical Property Profile of VU0499897-1
Property Insights of VU0499897-1
The XLogP value of 2.85892 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0499897-1. The TPSA of 93.22 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0499897-1. Following Lipinski's Rule of Five, VU0499897-1 has 0 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 VU0499897-1?
The CAS number of VU0499897-1 is 1001502-66-4.
What is the molecular formula of VU0499897-1?
The molecular formula of VU0499897-1 is C18H18ClN7O2.
What is the molecular weight of VU0499897-1?
The molecular weight of VU0499897-1 is 399.12 g/mol.
Where can I buy VU0499897-1?
You can request a quote for VU0499897-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0499897-1?
Yes, KEHONG BIO provides custom synthesis services for VU0499897-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.