![3-benzyl-2-[2-(1,2-dimethylindol-3-yl)ethenyl]-6-iodo-quinazolin-4-one structure](/static/products/385/385388-76-1.png)
3-benzyl-2-[2-(1,2-dimethylindol-3-yl)ethenyl]-6-iodo-quinazolin-4-one
TL;DR: 3-benzyl-2-[2-(1,2-dimethylindol-3-yl)ethenyl]-6-iodo-quinazolin-4-one (CAS 385388-76-1) is a chemical compound with molecular formula C27H22IN3O and molecular weight 531.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-2-[(E)-2-(1,2-dimethylindol-3-yl)ethenyl]-6-iodoquinazolin-4-one
Also Known As: 3-benzyl-2-[2-(1,2-dimethylindol-3-yl)ethenyl]-6-iodo-quinazolin-4-one, (E)-3-benzyl-2-(2-(1,2-dimethyl-1H-indol-3-yl)vinyl)-6-iodoquinazolin-4(3H)-one, 3-benzyl-2-[(E)-2-(1,2-dimethyl-1H-indol-3-yl)ethenyl]-6-iodoquinazolin-4(3H)-one, 3-benzyl-2-[(E)-2-(1,2-dimethylindol-3-yl)ethenyl]-6-iodoquinazolin-4-one
| Molecular Formula | C27H22IN3O |
|---|---|
| Molecular Weight | 531.08 g/mol |
| LogP | 6.01992 |
| Topological Polar Surface Area | 39.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 531.08075 |
| Heavy Atoms | 32 |
| Complexity | 1544.829 |
Chemical Identifiers
| CAS Number | 385388-76-1 |
|---|---|
| SMILES | CC1=C(C2=CC=CC=C2N1C)/C=C/C3=NC4=C(C=C(C=C4)I)C(=O)N3CC5=CC=CC=C5 |
Product Overview
3-benzyl-2-[2-(1,2-dimethylindol-3-yl)ethenyl]-6-iodo-quinazolin-4-one (CAS 385388-76-1), with molecular formula C27H22IN3O and molecular weight 531.08 g/mol. IUPAC: 3-benzyl-2-[(E)-2-(1,2-dimethylindol-3-yl)ethenyl]-6-iodoquinazolin-4-one.
Chemical Property Profile of 3-benzyl-2-[2-(1,2-dimethylindol-3-yl)ethenyl]-6-iodo-quinazolin-4-one
Property Insights of 3-benzyl-2-[2-(1,2-dimethylindol-3-yl)ethenyl]-6-iodo-quinazolin-4-one
The XLogP value of 6.01992 indicates that 3-benzyl-2-[2-(1,2-dimethylindol-3-yl)ethenyl]-6-iodo-quinazolin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.82 Ų, 3-benzyl-2-[2-(1,2-dimethylindol-3-yl)ethenyl]-6-iodo-quinazolin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-benzyl-2-[2-(1,2-dimethylindol-3-yl)ethenyl]-6-iodo-quinazolin-4-one has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-benzyl-2-[2-(1,2-dimethylindol-3-yl)ethenyl]-6-iodo-quinazolin-4-one?
The CAS number of 3-benzyl-2-[2-(1,2-dimethylindol-3-yl)ethenyl]-6-iodo-quinazolin-4-one is 385388-76-1.
What is the molecular formula of 3-benzyl-2-[2-(1,2-dimethylindol-3-yl)ethenyl]-6-iodo-quinazolin-4-one?
The molecular formula of 3-benzyl-2-[2-(1,2-dimethylindol-3-yl)ethenyl]-6-iodo-quinazolin-4-one is C27H22IN3O.
What is the molecular weight of 3-benzyl-2-[2-(1,2-dimethylindol-3-yl)ethenyl]-6-iodo-quinazolin-4-one?
The molecular weight of 3-benzyl-2-[2-(1,2-dimethylindol-3-yl)ethenyl]-6-iodo-quinazolin-4-one is 531.08 g/mol.
Where can I buy 3-benzyl-2-[2-(1,2-dimethylindol-3-yl)ethenyl]-6-iodo-quinazolin-4-one?
You can request a quote for 3-benzyl-2-[2-(1,2-dimethylindol-3-yl)ethenyl]-6-iodo-quinazolin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-benzyl-2-[2-(1,2-dimethylindol-3-yl)ethenyl]-6-iodo-quinazolin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-benzyl-2-[2-(1,2-dimethylindol-3-yl)ethenyl]-6-iodo-quinazolin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.