BRN 0853938
TL;DR: BRN 0853938 (CAS 36934-39-1) is a chemical compound with molecular formula C22H15Cl2N3O2 and molecular weight 423.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-[(3,5-dichloro-2-hydroxyphenyl)methylideneamino]phenyl]-2-methylquinazolin-4-one
Also Known As: 5-24-03-00141 (Beilstein Handbook Reference), 3-(4-(((3,5-Dichloro-2-hydroxyphenyl)methylene)amino)phenyl)-2-methyl-4(3H)-quinazolinone, 4(3H)-Quinazolinone, 3-(4-(((3,5-dichloro-2-hydroxyphenyl)methylene)amino)phenyl)-2-methyl-, 3-[4-[[(E)-(3,5-dichloro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-2-methylquinazolin-4-one, BRN 0853938
| Molecular Formula | C22H15Cl2N3O2 |
|---|---|
| Molecular Weight | 423.05 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 65.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 423.05414 |
| Heavy Atoms | 29 |
| Complexity | 662.0 |
Chemical Identifiers
| CAS Number | 36934-39-1 |
|---|---|
| SMILES | CC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)N=CC4=C(C(=CC(=C4)Cl)Cl)O |
| InChIKey | GQOWPCYZIRAATN-UHFFFAOYSA-N |
Product Overview
BRN 0853938 (CAS 36934-39-1), with molecular formula C22H15Cl2N3O2 and molecular weight 423.05 g/mol. IUPAC: 3-[4-[(3,5-dichloro-2-hydroxyphenyl)methylideneamino]phenyl]-2-methylquinazolin-4-one.
Chemical Property Profile of BRN 0853938
Property Insights of BRN 0853938
The XLogP value of 4.3 indicates that BRN 0853938 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.3 Ų falls within the moderate polarity range, balancing permeability and solubility for BRN 0853938. Following Lipinski's Rule of Five, BRN 0853938 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 BRN 0853938?
The CAS number of BRN 0853938 is 36934-39-1.
What is the molecular formula of BRN 0853938?
The molecular formula of BRN 0853938 is C22H15Cl2N3O2.
What is the molecular weight of BRN 0853938?
The molecular weight of BRN 0853938 is 423.05 g/mol.
Where can I buy BRN 0853938?
You can request a quote for BRN 0853938 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BRN 0853938?
Yes, KEHONG BIO provides custom synthesis services for BRN 0853938 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.