BAS 00429935
TL;DR: BAS 00429935 (CAS 5545-38-0) is a chemical compound with molecular formula C22H20N2O3 and molecular weight 360.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[2-hydroxyethyl(methyl)amino]-2-(2-methylphenyl)benzo[de]isoquinoline-1,3-dione
Also Known As: BAS 00429935, BIM-0023661.P001, 6-[2-hydroxyethyl(methyl)amino]-2-(2-methylphenyl)benzo[de]isoquinoline-1,3-dione, AB00088363-01, 6-[(2-hydroxyethyl)(methyl)amino]-2-(2-methylphenyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
| Molecular Formula | C22H20N2O3 |
|---|---|
| Molecular Weight | 360.15 g/mol |
| LogP | 3.37732 |
| Topological Polar Surface Area | 60.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 360.1474 |
| Heavy Atoms | 27 |
| Complexity | 1052.091 |
Chemical Identifiers
| CAS Number | 5545-38-0 |
|---|---|
| SMILES | CC1=CC=CC=C1N2C(=O)C3=C4C(=C(C=C3)N(C)CCO)C=CC=C4C2=O |
Product Overview
BAS 00429935 (CAS 5545-38-0), with molecular formula C22H20N2O3 and molecular weight 360.15 g/mol. IUPAC: 6-[2-hydroxyethyl(methyl)amino]-2-(2-methylphenyl)benzo[de]isoquinoline-1,3-dione.
Chemical Property Profile of BAS 00429935
Property Insights of BAS 00429935
The XLogP value of 3.37732 indicates that BAS 00429935 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.85 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00429935. Following Lipinski's Rule of Five, BAS 00429935 has 1 hydrogen bond donor(s) and 4 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 00429935?
The CAS number of BAS 00429935 is 5545-38-0.
What is the molecular formula of BAS 00429935?
The molecular formula of BAS 00429935 is C22H20N2O3.
What is the molecular weight of BAS 00429935?
The molecular weight of BAS 00429935 is 360.15 g/mol.
Where can I buy BAS 00429935?
You can request a quote for BAS 00429935 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00429935?
Yes, KEHONG BIO provides custom synthesis services for BAS 00429935 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.