VU0474031-1
TL;DR: VU0474031-1 (CAS 1164520-39-1) is a chemical compound with molecular formula C22H22N2O3 and molecular weight 362.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,5-dimethoxyphenyl)imino-9,11,11-trimethyl-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12),9-tetraen-2-one
Also Known As: VU0474031-1, (1E)-1-[(3,5-dimethoxyphenyl)imino]-4,4,6-trimethyl-4H-pyrrolo[3,2,1-ij]quinolin-2(1H)-one, 1-[(3,5-dimethoxyphenyl)imino]-4,4,6-trimethyl-4H-pyrrolo[3,2,1-ij]quinolin-2(1H)-one, 1-[(E)-3,5-Dimethoxy-phenylimino]-4,4,6-trimethyl-1H,4H-pyrrolo[3,2,1-ij]quinolin-2-one, (E)-1-((3,5-dimethoxyphenyl)imino)-4,4,6-trimethyl-1H-pyrrolo[3,2,1-ij]quinolin-2(4H)-one
| Molecular Formula | C22H22N2O3 |
|---|---|
| Molecular Weight | 362.16 g/mol |
| LogP | 4.3667 |
| Topological Polar Surface Area | 51.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 362.16306 |
| Heavy Atoms | 27 |
| Complexity | 995.96313 |
Chemical Identifiers
| CAS Number | 1164520-39-1 |
|---|---|
| SMILES | CC1=CC(N2C3=C1C=CC=C3C(=NC4=CC(=CC(=C4)OC)OC)C2=O)(C)C |
Product Overview
VU0474031-1 (CAS 1164520-39-1), with molecular formula C22H22N2O3 and molecular weight 362.16 g/mol. IUPAC: 3-(3,5-dimethoxyphenyl)imino-9,11,11-trimethyl-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12),9-tetraen-2-one.
Chemical Property Profile of VU0474031-1
Property Insights of VU0474031-1
The XLogP value of 4.3667 indicates that VU0474031-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.13 Ų, VU0474031-1 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, VU0474031-1 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 VU0474031-1?
The CAS number of VU0474031-1 is 1164520-39-1.
What is the molecular formula of VU0474031-1?
The molecular formula of VU0474031-1 is C22H22N2O3.
What is the molecular weight of VU0474031-1?
The molecular weight of VU0474031-1 is 362.16 g/mol.
Where can I buy VU0474031-1?
You can request a quote for VU0474031-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0474031-1?
Yes, KEHONG BIO provides custom synthesis services for VU0474031-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.