![1-[(2Z)-5-(3,4-dichlorobenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylurea structure](/static/products/424/424801-62-7.png)
1-[(2Z)-5-(3,4-dichlorobenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylurea
TL;DR: 1-[(2Z)-5-(3,4-dichlorobenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylurea (CAS 424801-62-7) is a chemical compound with molecular formula C16H12Cl2N4OS and molecular weight 378.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[5-[(3,4-dichlorophenyl)methyl]-1,3,4-thiadiazol-2-yl]-3-phenylurea
Also Known As: BIM-0010443.P001, 1-(5-(3,4-dichlorobenzyl)-1,3,4-thiadiazol-2-yl)-3-phenylurea, N-[5-(3,4-dichlorobenzyl)-1,3,4-thiadiazol-2-yl]-N'-phenylurea, 1-[5-[(3,4-dichlorophenyl)methyl]-1,3,4-thiadiazol-2-yl]-3-phenylurea, 1-[(2Z)-5-(3,4-dichlorobenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylurea
| Molecular Formula | C16H12Cl2N4OS |
|---|---|
| Molecular Weight | 378.01 g/mol |
| LogP | 5.0797 |
| Topological Polar Surface Area | 66.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 378.0109 |
| Heavy Atoms | 24 |
| Complexity | 854.2936 |
Chemical Identifiers
| CAS Number | 424801-62-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)NC2=NN=C(S2)CC3=CC(=C(C=C3)Cl)Cl |
Product Overview
1-[(2Z)-5-(3,4-dichlorobenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylurea (CAS 424801-62-7), with molecular formula C16H12Cl2N4OS and molecular weight 378.01 g/mol. IUPAC: 1-[5-[(3,4-dichlorophenyl)methyl]-1,3,4-thiadiazol-2-yl]-3-phenylurea.
Chemical Property Profile of 1-[(2Z)-5-(3,4-dichlorobenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylurea
Property Insights of 1-[(2Z)-5-(3,4-dichlorobenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylurea
The XLogP value of 5.0797 indicates that 1-[(2Z)-5-(3,4-dichlorobenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylurea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(2Z)-5-(3,4-dichlorobenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylurea. Following Lipinski's Rule of Five, 1-[(2Z)-5-(3,4-dichlorobenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylurea has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-[(2Z)-5-(3,4-dichlorobenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylurea?
The CAS number of 1-[(2Z)-5-(3,4-dichlorobenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylurea is 424801-62-7.
What is the molecular formula of 1-[(2Z)-5-(3,4-dichlorobenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylurea?
The molecular formula of 1-[(2Z)-5-(3,4-dichlorobenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylurea is C16H12Cl2N4OS.
What is the molecular weight of 1-[(2Z)-5-(3,4-dichlorobenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylurea?
The molecular weight of 1-[(2Z)-5-(3,4-dichlorobenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylurea is 378.01 g/mol.
Where can I buy 1-[(2Z)-5-(3,4-dichlorobenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylurea?
You can request a quote for 1-[(2Z)-5-(3,4-dichlorobenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(2Z)-5-(3,4-dichlorobenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylurea?
Yes, KEHONG BIO provides custom synthesis services for 1-[(2Z)-5-(3,4-dichlorobenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.