N-(3,4-dichlorobenzyl)-N'-1H-indazol-4-ylurea
TL;DR: N-(3,4-dichlorobenzyl)-N'-1H-indazol-4-ylurea (CAS 581810-53-9) is a chemical compound with molecular formula C15H12Cl2N4O and molecular weight 334.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3,4-dichlorophenyl)methyl]-3-(1H-indazol-4-yl)urea
Also Known As: heterocyclic urea, 46, N-(3,4-dichlorobenzyl)-N'-1H-indazol-4-ylurea, 1-[(3,4-dichlorophenyl)methyl]-3-1H-indazol-4-ylurea, 3-[(3,4-dichlorophenyl)methyl]-1-(1H-indazol-4-yl)urea
| Molecular Formula | C15H12Cl2N4O |
|---|---|
| Molecular Weight | 334.04 g/mol |
| LogP | 4.1914 |
| Topological Polar Surface Area | 69.81 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 334.03882 |
| Heavy Atoms | 22 |
| Complexity | 831.27545 |
Chemical Identifiers
| CAS Number | 581810-53-9 |
|---|---|
| SMILES | C1=CC2=C(C=NN2)C(=C1)NC(=O)NCC3=CC(=C(C=C3)Cl)Cl |
Product Overview
N-(3,4-dichlorobenzyl)-N'-1H-indazol-4-ylurea (CAS 581810-53-9), with molecular formula C15H12Cl2N4O and molecular weight 334.04 g/mol. IUPAC: 1-[(3,4-dichlorophenyl)methyl]-3-(1H-indazol-4-yl)urea.
Chemical Property Profile of N-(3,4-dichlorobenzyl)-N'-1H-indazol-4-ylurea
Property Insights of N-(3,4-dichlorobenzyl)-N'-1H-indazol-4-ylurea
The XLogP value of 4.1914 indicates that N-(3,4-dichlorobenzyl)-N'-1H-indazol-4-ylurea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.81 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3,4-dichlorobenzyl)-N'-1H-indazol-4-ylurea. Following Lipinski's Rule of Five, N-(3,4-dichlorobenzyl)-N'-1H-indazol-4-ylurea has 3 hydrogen bond donor(s) and 2 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 N-(3,4-dichlorobenzyl)-N'-1H-indazol-4-ylurea?
The CAS number of N-(3,4-dichlorobenzyl)-N'-1H-indazol-4-ylurea is 581810-53-9.
What is the molecular formula of N-(3,4-dichlorobenzyl)-N'-1H-indazol-4-ylurea?
The molecular formula of N-(3,4-dichlorobenzyl)-N'-1H-indazol-4-ylurea is C15H12Cl2N4O.
What is the molecular weight of N-(3,4-dichlorobenzyl)-N'-1H-indazol-4-ylurea?
The molecular weight of N-(3,4-dichlorobenzyl)-N'-1H-indazol-4-ylurea is 334.04 g/mol.
Where can I buy N-(3,4-dichlorobenzyl)-N'-1H-indazol-4-ylurea?
You can request a quote for N-(3,4-dichlorobenzyl)-N'-1H-indazol-4-ylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3,4-dichlorobenzyl)-N'-1H-indazol-4-ylurea?
Yes, KEHONG BIO provides custom synthesis services for N-(3,4-dichlorobenzyl)-N'-1H-indazol-4-ylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.