RefChem:322278
TL;DR: RefChem:322278 (CAS 87444-01-7) is a chemical compound with molecular formula C24H21BrClN3O5 and molecular weight 545.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-[(4-bromoanilino)methyl]-3-chloro-2-(3-hydroxy-4-methoxyphenyl)-4-oxoazetidin-1-yl]-2-hydroxybenzamide
Also Known As: Benzamide, N-(3-(((4-bromophenyl)amino)methyl)-3-chloro-2-(3-hydroxy-4-methoxyphenyl)-4-oxo-1-azetidinyl)-2-hydroxy-, N-[3-[(4-bromoanilino)methyl]-3-chloro-2-(3-hydroxy-4-methoxyphenyl)-4-oxoazetidin-1-yl]-2-hydroxybenzamide, BENZAMIDE, N-(3-(((4-BROMOPHENYL)AMINO)METHYL)-3-CHLORO-2-(3-HYDROXY-4-METHOXYPH, N-{3-[(4-Bromoanilino)methyl]-3-chloro-2-(3-hydroxy-4-methoxyphenyl)-4-oxoazetidin-1-yl}-2-hydroxybenzene-1-carboximidic acid, RefChem:322278
| Molecular Formula | C24H21BrClN3O5 |
|---|---|
| Molecular Weight | 545.04 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 545.03534 |
| Heavy Atoms | 34 |
| Complexity | 739.0 |
Chemical Identifiers
| CAS Number | 87444-01-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2C(C(=O)N2NC(=O)C3=CC=CC=C3O)(CNC4=CC=C(C=C4)Br)Cl)O |
| InChIKey | FSSASFIRTVQVTG-UHFFFAOYSA-N |
Product Overview
RefChem:322278 (CAS 87444-01-7), with molecular formula C24H21BrClN3O5 and molecular weight 545.04 g/mol. IUPAC: N-[3-[(4-bromoanilino)methyl]-3-chloro-2-(3-hydroxy-4-methoxyphenyl)-4-oxoazetidin-1-yl]-2-hydroxybenzamide.
Chemical Property Profile of RefChem:322278
Property Insights of RefChem:322278
The XLogP value of 4.9 indicates that RefChem:322278 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:322278. Following Lipinski's Rule of Five, RefChem:322278 has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:322278?
The CAS number of RefChem:322278 is 87444-01-7.
What is the molecular formula of RefChem:322278?
The molecular formula of RefChem:322278 is C24H21BrClN3O5.
What is the molecular weight of RefChem:322278?
The molecular weight of RefChem:322278 is 545.04 g/mol.
Where can I buy RefChem:322278?
You can request a quote for RefChem:322278 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:322278?
Yes, KEHONG BIO provides custom synthesis services for RefChem:322278 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.