BRN 4588550
TL;DR: BRN 4588550 (CAS 74767-15-0) is a chemical compound with molecular formula C27H23N3O3 and molecular weight 437.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,7-dimethylquinolin-4-yl) 2-[(4-acetamidophenyl)methylideneamino]benzoate
Also Known As: 2-(((4-(Acetylamino)phenyl)methylene)amino)benzoic acid, 2,7-dimethyl-4-quinolinyl ester, Benzoic acid, 2-(((4-(acetylamino)phenyl)methylene)amino)-, 2,7-dimethyl-4-quinolinyl ester, (2,7-dimethylquinolin-4-yl) 2-[(4-acetamidophenyl)methylideneamino]benzoate, BRN 4588550
| Molecular Formula | C27H23N3O3 |
|---|---|
| Molecular Weight | 437.17 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 80.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 437.17395 |
| Heavy Atoms | 33 |
| Complexity | 703.0 |
Chemical Identifiers
| CAS Number | 74767-15-0 |
|---|---|
| SMILES | CC1=CC2=NC(=CC(=C2C=C1)OC(=O)C3=CC=CC=C3N=CC4=CC=C(C=C4)NC(=O)C)C |
| InChIKey | FXSJQIIUUIXMCV-UHFFFAOYSA-N |
Product Overview
BRN 4588550 (CAS 74767-15-0), with molecular formula C27H23N3O3 and molecular weight 437.17 g/mol. IUPAC: (2,7-dimethylquinolin-4-yl) 2-[(4-acetamidophenyl)methylideneamino]benzoate.
Chemical Property Profile of BRN 4588550
Property Insights of BRN 4588550
The XLogP value of 4.8 indicates that BRN 4588550 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.7 Ų falls within the moderate polarity range, balancing permeability and solubility for BRN 4588550. Following Lipinski's Rule of Five, BRN 4588550 has 1 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 BRN 4588550?
The CAS number of BRN 4588550 is 74767-15-0.
What is the molecular formula of BRN 4588550?
The molecular formula of BRN 4588550 is C27H23N3O3.
What is the molecular weight of BRN 4588550?
The molecular weight of BRN 4588550 is 437.17 g/mol.
Where can I buy BRN 4588550?
You can request a quote for BRN 4588550 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BRN 4588550?
Yes, KEHONG BIO provides custom synthesis services for BRN 4588550 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.