N~1~,N~3~-Bis(5-chloro-2-methylphenyl)-4-hydroxybenzene-1,3-dicarboximidic acid
TL;DR: N~1~,N~3~-Bis(5-chloro-2-methylphenyl)-4-hydroxybenzene-1,3-dicarboximidic acid (CAS 29114-44-1) is a chemical compound with molecular formula C22H18Cl2N2O3 and molecular weight 428.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-N,3-N-bis(5-chloro-2-methylphenyl)-4-hydroxybenzene-1,3-dicarboxamide
Also Known As: 5',5''-Dichloro-4-hydroxy-o-isophthalotoluidide, o-Isophthalotoluidide, 5',5''-dichloro-4-hydroxy-, N~1~,N~3~-Bis(5-chloro-2-methylphenyl)-4-hydroxybenzene-1,3-dicarboximidic acid, 1-N,3-N-bis(5-chloro-2-methylphenyl)-4-hydroxybenzene-1,3-dicarboxamide, RefChem:1093396
| Molecular Formula | C22H18Cl2N2O3 |
|---|---|
| Molecular Weight | 428.07 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 78.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 428.06946 |
| Heavy Atoms | 29 |
| Complexity | 590.0 |
Chemical Identifiers
| CAS Number | 29114-44-1 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)Cl)NC(=O)C2=CC(=C(C=C2)O)C(=O)NC3=C(C=CC(=C3)Cl)C |
| InChIKey | KFTMGXVFMUSIEW-UHFFFAOYSA-N |
Product Overview
N~1~,N~3~-Bis(5-chloro-2-methylphenyl)-4-hydroxybenzene-1,3-dicarboximidic acid (CAS 29114-44-1), with molecular formula C22H18Cl2N2O3 and molecular weight 428.07 g/mol. IUPAC: 1-N,3-N-bis(5-chloro-2-methylphenyl)-4-hydroxybenzene-1,3-dicarboxamide.
Chemical Property Profile of N~1~,N~3~-Bis(5-chloro-2-methylphenyl)-4-hydroxybenzene-1,3-dicarboximidic acid
Property Insights of N~1~,N~3~-Bis(5-chloro-2-methylphenyl)-4-hydroxybenzene-1,3-dicarboximidic acid
The XLogP value of 5.8 indicates that N~1~,N~3~-Bis(5-chloro-2-methylphenyl)-4-hydroxybenzene-1,3-dicarboximidic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N~1~,N~3~-Bis(5-chloro-2-methylphenyl)-4-hydroxybenzene-1,3-dicarboximidic acid. Following Lipinski's Rule of Five, N~1~,N~3~-Bis(5-chloro-2-methylphenyl)-4-hydroxybenzene-1,3-dicarboximidic acid has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N~1~,N~3~-Bis(5-chloro-2-methylphenyl)-4-hydroxybenzene-1,3-dicarboximidic acid?
The CAS number of N~1~,N~3~-Bis(5-chloro-2-methylphenyl)-4-hydroxybenzene-1,3-dicarboximidic acid is 29114-44-1.
What is the molecular formula of N~1~,N~3~-Bis(5-chloro-2-methylphenyl)-4-hydroxybenzene-1,3-dicarboximidic acid?
The molecular formula of N~1~,N~3~-Bis(5-chloro-2-methylphenyl)-4-hydroxybenzene-1,3-dicarboximidic acid is C22H18Cl2N2O3.
What is the molecular weight of N~1~,N~3~-Bis(5-chloro-2-methylphenyl)-4-hydroxybenzene-1,3-dicarboximidic acid?
The molecular weight of N~1~,N~3~-Bis(5-chloro-2-methylphenyl)-4-hydroxybenzene-1,3-dicarboximidic acid is 428.07 g/mol.
Where can I buy N~1~,N~3~-Bis(5-chloro-2-methylphenyl)-4-hydroxybenzene-1,3-dicarboximidic acid?
You can request a quote for N~1~,N~3~-Bis(5-chloro-2-methylphenyl)-4-hydroxybenzene-1,3-dicarboximidic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N~1~,N~3~-Bis(5-chloro-2-methylphenyl)-4-hydroxybenzene-1,3-dicarboximidic acid?
Yes, KEHONG BIO provides custom synthesis services for N~1~,N~3~-Bis(5-chloro-2-methylphenyl)-4-hydroxybenzene-1,3-dicarboximidic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.