VU0605359-1
TL;DR: VU0605359-1 (CAS 881565-75-9) is a chemical compound with molecular formula C21H16N4O and molecular weight 340.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-3-methyl-2-[(3-methylanilino)methylidene]-1-oxopyrido[1,2-a]benzimidazole-4-carbonitrile
Also Known As: VU0605359-1, F3225-8472, (12E)-11-methyl-12-{[(3-methylphenyl)amino]methylidene}-13-oxo-1,8-diazatricyclo[7.4.0.0^{2,7}]trideca-2,4,6,8,10-pentaene-10-carbonitrile, (2E)-3-methyl-2-[(3-methylanilino)methylidene]-1-oxopyrido[1,2-a]benzimidazole-4-carbonitrile, (2E)-3-methyl-2-{[(3-methylphenyl)amino]methylidene}-1-oxo-1,2-dihydropyrido[1,2-a]benzimidazole-4-carbonitrile
| Molecular Formula | C21H16N4O |
|---|---|
| Molecular Weight | 340.13 g/mol |
| LogP | 2.90522 |
| Topological Polar Surface Area | 70.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 340.13242 |
| Heavy Atoms | 26 |
| Complexity | 1312.0804 |
Chemical Identifiers
| CAS Number | 881565-75-9 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N/C=C/2\C(=C(C3=NC4=CC=CC=C4N3C2=O)C#N)C |
Product Overview
VU0605359-1 (CAS 881565-75-9), with molecular formula C21H16N4O and molecular weight 340.13 g/mol. IUPAC: (2E)-3-methyl-2-[(3-methylanilino)methylidene]-1-oxopyrido[1,2-a]benzimidazole-4-carbonitrile.
Chemical Property Profile of VU0605359-1
Property Insights of VU0605359-1
The XLogP value of 2.90522 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0605359-1. The TPSA of 70.19 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0605359-1. Following Lipinski's Rule of Five, VU0605359-1 has 1 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 VU0605359-1?
The CAS number of VU0605359-1 is 881565-75-9.
What is the molecular formula of VU0605359-1?
The molecular formula of VU0605359-1 is C21H16N4O.
What is the molecular weight of VU0605359-1?
The molecular weight of VU0605359-1 is 340.13 g/mol.
Where can I buy VU0605359-1?
You can request a quote for VU0605359-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0605359-1?
Yes, KEHONG BIO provides custom synthesis services for VU0605359-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.