BAS 01672680
TL;DR: BAS 01672680 (CAS 324044-81-7) is a chemical compound with molecular formula C28H27N3O4 and molecular weight 469.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[4-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]piperazin-1-yl]ethyl]benzo[de]isoquinoline-1,3-dione
Also Known As: BAS 01672680, BIM-0027623.P001, F0238-0029, (E)-2-(2-(4-(3-(4-methoxyphenyl)acryloyl)piperazin-1-yl)ethyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione, 3-(2-{4-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]piperazin-1-yl}ethyl)-3-azatricyclo[7.3.1.0^{5,13}]trideca-1(13),5,7,9,11-pentaene-2,4-dione
| Molecular Formula | C28H27N3O4 |
|---|---|
| Molecular Weight | 469.20 g/mol |
| LogP | 3.302 |
| Topological Polar Surface Area | 70.16 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 469.20016 |
| Heavy Atoms | 35 |
| Complexity | 1256.7819 |
Chemical Identifiers
| CAS Number | 324044-81-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)/C=C/C(=O)N2CCN(CC2)CCN3C(=O)C4=CC=CC5=C4C(=CC=C5)C3=O |
Product Overview
BAS 01672680 (CAS 324044-81-7), with molecular formula C28H27N3O4 and molecular weight 469.20 g/mol. IUPAC: 2-[2-[4-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]piperazin-1-yl]ethyl]benzo[de]isoquinoline-1,3-dione.
Chemical Property Profile of BAS 01672680
Property Insights of BAS 01672680
The XLogP value of 3.302 indicates that BAS 01672680 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.16 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01672680. Following Lipinski's Rule of Five, BAS 01672680 has 0 hydrogen bond donor(s) and 5 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 BAS 01672680?
The CAS number of BAS 01672680 is 324044-81-7.
What is the molecular formula of BAS 01672680?
The molecular formula of BAS 01672680 is C28H27N3O4.
What is the molecular weight of BAS 01672680?
The molecular weight of BAS 01672680 is 469.20 g/mol.
Where can I buy BAS 01672680?
You can request a quote for BAS 01672680 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01672680?
Yes, KEHONG BIO provides custom synthesis services for BAS 01672680 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.