VU0064990-2
TL;DR: VU0064990-2 (CAS 442572-64-7) is a chemical compound with molecular formula C21H25N5 and molecular weight 347.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-1-(4-methylpiperazin-1-yl)-2-propan-2-ylpyrido[1,2-a]benzimidazole-4-carbonitrile
Also Known As: VU0064990-2, 2-isopropyl-3-methyl-1-(4-methyl-1-piperazinyl)pyrido[1,2-a]benzimidazole-4-carbonitrile, 2-isopropyl-3-methyl-1-(4-methylpiperazin-1-yl)benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile, F1126-0386, 3-methyl-1-(4-methylpiperazin-1-yl)-2-propan-2-ylpyrido[1,2-a]benzimidazole-4-carbonitrile
| Molecular Formula | C21H25N5 |
|---|---|
| Molecular Weight | 347.21 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 347.211 |
| Heavy Atoms | 26 |
| Complexity | 546.0 |
Chemical Identifiers
| CAS Number | 442572-64-7 |
|---|---|
| SMILES | CC1=C(C2=NC3=CC=CC=C3N2C(=C1C(C)C)N4CCN(CC4)C)C#N |
| InChIKey | WELCIUOZVMUYHU-UHFFFAOYSA-N |
Product Overview
VU0064990-2 (CAS 442572-64-7), with molecular formula C21H25N5 and molecular weight 347.21 g/mol. IUPAC: 3-methyl-1-(4-methylpiperazin-1-yl)-2-propan-2-ylpyrido[1,2-a]benzimidazole-4-carbonitrile.
Chemical Property Profile of VU0064990-2
Property Insights of VU0064990-2
The XLogP value of 4.7 indicates that VU0064990-2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.6 Ų, VU0064990-2 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, VU0064990-2 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 VU0064990-2?
The CAS number of VU0064990-2 is 442572-64-7.
What is the molecular formula of VU0064990-2?
The molecular formula of VU0064990-2 is C21H25N5.
What is the molecular weight of VU0064990-2?
The molecular weight of VU0064990-2 is 347.21 g/mol.
Where can I buy VU0064990-2?
You can request a quote for VU0064990-2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0064990-2?
Yes, KEHONG BIO provides custom synthesis services for VU0064990-2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.