4(3H)-Quinazolinone, 6-bromo-3-(1H-indol-3-ylmethyl)-
TL;DR: 4(3H)-Quinazolinone, 6-bromo-3-(1H-indol-3-ylmethyl)- (CAS 88514-44-7) is a chemical compound with molecular formula C17H12BrN3O and molecular weight 353.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-bromo-3-(1H-indol-3-ylmethyl)quinazolin-4-one
Also Known As: 4(3H)-Quinazolinone, 6-bromo-3-(1H-indol-3-ylmethyl)-, 6-Bromo-3-(1H-indol-3-ylmethyl)-4(3H)-quinazolinone, 6-bromo-3-(1H-indol-3-ylmethyl)quinazolin-4-one, 6-Bromo-3-[(1H-indol-3-yl)methyl]quinazolin-4(3H)-one, RefChem:284262
| Molecular Formula | C17H12BrN3O |
|---|---|
| Molecular Weight | 353.02 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 48.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 353.01636 |
| Heavy Atoms | 22 |
| Complexity | 469.0 |
Chemical Identifiers
| CAS Number | 88514-44-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2)CN3C=NC4=C(C3=O)C=C(C=C4)Br |
| InChIKey | KPSJDFSBBHIUJZ-UHFFFAOYSA-N |
Product Overview
4(3H)-Quinazolinone, 6-bromo-3-(1H-indol-3-ylmethyl)- (CAS 88514-44-7), with molecular formula C17H12BrN3O and molecular weight 353.02 g/mol. IUPAC: 6-bromo-3-(1H-indol-3-ylmethyl)quinazolin-4-one.
Chemical Property Profile of 4(3H)-Quinazolinone, 6-bromo-3-(1H-indol-3-ylmethyl)-
Property Insights of 4(3H)-Quinazolinone, 6-bromo-3-(1H-indol-3-ylmethyl)-
The XLogP value of 3.2 indicates that 4(3H)-Quinazolinone, 6-bromo-3-(1H-indol-3-ylmethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.5 Ų, 4(3H)-Quinazolinone, 6-bromo-3-(1H-indol-3-ylmethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4(3H)-Quinazolinone, 6-bromo-3-(1H-indol-3-ylmethyl)- has 1 hydrogen bond donor(s) and 2 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 4(3H)-Quinazolinone, 6-bromo-3-(1H-indol-3-ylmethyl)-?
The CAS number of 4(3H)-Quinazolinone, 6-bromo-3-(1H-indol-3-ylmethyl)- is 88514-44-7.
What is the molecular formula of 4(3H)-Quinazolinone, 6-bromo-3-(1H-indol-3-ylmethyl)-?
The molecular formula of 4(3H)-Quinazolinone, 6-bromo-3-(1H-indol-3-ylmethyl)- is C17H12BrN3O.
What is the molecular weight of 4(3H)-Quinazolinone, 6-bromo-3-(1H-indol-3-ylmethyl)-?
The molecular weight of 4(3H)-Quinazolinone, 6-bromo-3-(1H-indol-3-ylmethyl)- is 353.02 g/mol.
Where can I buy 4(3H)-Quinazolinone, 6-bromo-3-(1H-indol-3-ylmethyl)-?
You can request a quote for 4(3H)-Quinazolinone, 6-bromo-3-(1H-indol-3-ylmethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4(3H)-Quinazolinone, 6-bromo-3-(1H-indol-3-ylmethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 4(3H)-Quinazolinone, 6-bromo-3-(1H-indol-3-ylmethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.