3-(3-(3,4-Dichlorophenyl)ureido)-4-(piperidin-1-yl)benzoic acid
TL;DR: 3-(3-(3,4-Dichlorophenyl)ureido)-4-(piperidin-1-yl)benzoic acid (CAS 897766-48-2) is a chemical compound with molecular formula C19H19Cl2N3O3 and molecular weight 407.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(3,4-dichlorophenyl)carbamoylamino]-4-piperidin-1-ylbenzoic acid
Also Known As: 3-(3-(3,4-Dichlorophenyl)ureido)-4-(piperidin-1-yl)benzoic acid, 3-[(3,4-dichlorophenyl)carbamoylamino]-4-(1-piperidyl)benzoic Acid, 3-[(3,4-dichlorophenyl)carbamoylamino]-4-piperidin-1-ylbenzoic acid
| Molecular Formula | C19H19Cl2N3O3 |
|---|---|
| Molecular Weight | 407.08 g/mol |
| LogP | 5.3259 |
| Topological Polar Surface Area | 81.67 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 407.08035 |
| Heavy Atoms | 27 |
| Complexity | 867.27356 |
Chemical Identifiers
| CAS Number | 897766-48-2 |
|---|---|
| SMILES | C1CCN(CC1)C2=C(C=C(C=C2)C(=O)O)NC(=O)NC3=CC(=C(C=C3)Cl)Cl |
Product Overview
3-(3-(3,4-Dichlorophenyl)ureido)-4-(piperidin-1-yl)benzoic acid (CAS 897766-48-2), with molecular formula C19H19Cl2N3O3 and molecular weight 407.08 g/mol. IUPAC: 3-[(3,4-dichlorophenyl)carbamoylamino]-4-piperidin-1-ylbenzoic acid.
Chemical Property Profile of 3-(3-(3,4-Dichlorophenyl)ureido)-4-(piperidin-1-yl)benzoic acid
Property Insights of 3-(3-(3,4-Dichlorophenyl)ureido)-4-(piperidin-1-yl)benzoic acid
The XLogP value of 5.3259 indicates that 3-(3-(3,4-Dichlorophenyl)ureido)-4-(piperidin-1-yl)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3-(3,4-Dichlorophenyl)ureido)-4-(piperidin-1-yl)benzoic acid. Following Lipinski's Rule of Five, 3-(3-(3,4-Dichlorophenyl)ureido)-4-(piperidin-1-yl)benzoic 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 3-(3-(3,4-Dichlorophenyl)ureido)-4-(piperidin-1-yl)benzoic acid?
The CAS number of 3-(3-(3,4-Dichlorophenyl)ureido)-4-(piperidin-1-yl)benzoic acid is 897766-48-2.
What is the molecular formula of 3-(3-(3,4-Dichlorophenyl)ureido)-4-(piperidin-1-yl)benzoic acid?
The molecular formula of 3-(3-(3,4-Dichlorophenyl)ureido)-4-(piperidin-1-yl)benzoic acid is C19H19Cl2N3O3.
What is the molecular weight of 3-(3-(3,4-Dichlorophenyl)ureido)-4-(piperidin-1-yl)benzoic acid?
The molecular weight of 3-(3-(3,4-Dichlorophenyl)ureido)-4-(piperidin-1-yl)benzoic acid is 407.08 g/mol.
Where can I buy 3-(3-(3,4-Dichlorophenyl)ureido)-4-(piperidin-1-yl)benzoic acid?
You can request a quote for 3-(3-(3,4-Dichlorophenyl)ureido)-4-(piperidin-1-yl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-(3,4-Dichlorophenyl)ureido)-4-(piperidin-1-yl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-(3,4-Dichlorophenyl)ureido)-4-(piperidin-1-yl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.