BAS 00129462
TL;DR: BAS 00129462 (CAS 5130-75-6) is a chemical compound with molecular formula C23H17BrN2O and molecular weight 416.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(E)-2-(4-bromophenyl)ethenyl]-3-(4-methylphenyl)quinazolin-4-one
Also Known As: BAS 00129462, J2.680.597J, 2-(4-Bromostyryl)-3-(p-tolyl)-4(3H)-quinazolinone, 2-(4-Bromostyryl)-3-(4-methylphenyl)quinazoline-4(3H)-one, 2-[2-(4-Bromo-phenyl)-vinyl]-3-p-tolyl-3H-quinazolin-4-one
| Molecular Formula | C23H17BrN2O |
|---|---|
| Molecular Weight | 416.05 g/mol |
| LogP | 5.62702 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 416.05243 |
| Heavy Atoms | 27 |
| Complexity | 1189.959 |
Chemical Identifiers
| CAS Number | 5130-75-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)/C=C/C4=CC=C(C=C4)Br |
Product Overview
BAS 00129462 (CAS 5130-75-6), with molecular formula C23H17BrN2O and molecular weight 416.05 g/mol. IUPAC: 2-[(E)-2-(4-bromophenyl)ethenyl]-3-(4-methylphenyl)quinazolin-4-one.
Chemical Property Profile of BAS 00129462
Property Insights of BAS 00129462
The XLogP value of 5.62702 indicates that BAS 00129462 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, BAS 00129462 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00129462 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 BAS 00129462?
The CAS number of BAS 00129462 is 5130-75-6.
What is the molecular formula of BAS 00129462?
The molecular formula of BAS 00129462 is C23H17BrN2O.
What is the molecular weight of BAS 00129462?
The molecular weight of BAS 00129462 is 416.05 g/mol.
Where can I buy BAS 00129462?
You can request a quote for BAS 00129462 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00129462?
Yes, KEHONG BIO provides custom synthesis services for BAS 00129462 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.