BAS 00604896
TL;DR: BAS 00604896 (CAS 330833-09-5) is a chemical compound with molecular formula C28H25N3O2 and molecular weight 435.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(E)-2-(5-methoxy-1,2-dimethylindol-3-yl)ethenyl]-3-(4-methylphenyl)quinazolin-4-one
Also Known As: BAS 00604896, 2-[(E)-2-(5-methoxy-1,2-dimethylindol-3-yl)ethenyl]-3-(4-methylphenyl)quinazolin-4-one, AL-281/11335121, 2-[2-(5-methoxy-1,2-dimethyl-1H-indol-3-yl)vinyl]-3-(4-methylphenyl)-4(3H)-quinazolinone, 2-[(E)-2-(5-methoxy-1,2-dimethyl-1H-indol-3-yl)ethenyl]-3-(4-methylphenyl)quinazolin-4(3H)-one
| Molecular Formula | C28H25N3O2 |
|---|---|
| Molecular Weight | 435.19 g/mol |
| LogP | 5.67324 |
| Topological Polar Surface Area | 49.05 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 435.19467 |
| Heavy Atoms | 33 |
| Complexity | 1588.4033 |
Chemical Identifiers
| CAS Number | 330833-09-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)/C=C/C4=C(N(C5=C4C=C(C=C5)OC)C)C |
Product Overview
BAS 00604896 (CAS 330833-09-5), with molecular formula C28H25N3O2 and molecular weight 435.19 g/mol. IUPAC: 2-[(E)-2-(5-methoxy-1,2-dimethylindol-3-yl)ethenyl]-3-(4-methylphenyl)quinazolin-4-one.
Chemical Property Profile of BAS 00604896
Property Insights of BAS 00604896
The XLogP value of 5.67324 indicates that BAS 00604896 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.05 Ų, BAS 00604896 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00604896 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00604896?
The CAS number of BAS 00604896 is 330833-09-5.
What is the molecular formula of BAS 00604896?
The molecular formula of BAS 00604896 is C28H25N3O2.
What is the molecular weight of BAS 00604896?
The molecular weight of BAS 00604896 is 435.19 g/mol.
Where can I buy BAS 00604896?
You can request a quote for BAS 00604896 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00604896?
Yes, KEHONG BIO provides custom synthesis services for BAS 00604896 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.