1-(5-Benzhydryl-1,3,4-thiadiazol-2-yl)-3-(3,4-dimethylphenyl)urea
TL;DR: 1-(5-Benzhydryl-1,3,4-thiadiazol-2-yl)-3-(3,4-dimethylphenyl)urea (CAS 429628-51-3) is a chemical compound with molecular formula C24H22N4OS and molecular weight 414.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-benzhydryl-1,3,4-thiadiazol-2-yl)-3-(3,4-dimethylphenyl)urea
Also Known As: 1-(5-benzhydryl-1,3,4-thiadiazol-2-yl)-3-(3,4-dimethylphenyl)urea, 1-(3,4-dimethylphenyl)-3-[5-(diphenylmethyl)-1,3,4-thiadiazol-2-yl]urea, 1-(3,4-dimethylphenyl)-3-[(2Z)-5-(diphenylmethyl)-1,3,4-thiadiazol-2(3H)-ylidene]urea
| Molecular Formula | C24H22N4OS |
|---|---|
| Molecular Weight | 414.15 g/mol |
| LogP | 5.97914 |
| Topological Polar Surface Area | 66.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 414.15143 |
| Heavy Atoms | 30 |
| Complexity | 1102.8568 |
Chemical Identifiers
| CAS Number | 429628-51-3 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)NC2=NN=C(S2)C(C3=CC=CC=C3)C4=CC=CC=C4)C |
Product Overview
1-(5-Benzhydryl-1,3,4-thiadiazol-2-yl)-3-(3,4-dimethylphenyl)urea (CAS 429628-51-3), with molecular formula C24H22N4OS and molecular weight 414.15 g/mol. IUPAC: 1-(5-benzhydryl-1,3,4-thiadiazol-2-yl)-3-(3,4-dimethylphenyl)urea.
Chemical Property Profile of 1-(5-Benzhydryl-1,3,4-thiadiazol-2-yl)-3-(3,4-dimethylphenyl)urea
Property Insights of 1-(5-Benzhydryl-1,3,4-thiadiazol-2-yl)-3-(3,4-dimethylphenyl)urea
The XLogP value of 5.97914 indicates that 1-(5-Benzhydryl-1,3,4-thiadiazol-2-yl)-3-(3,4-dimethylphenyl)urea 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-(5-Benzhydryl-1,3,4-thiadiazol-2-yl)-3-(3,4-dimethylphenyl)urea. Following Lipinski's Rule of Five, 1-(5-Benzhydryl-1,3,4-thiadiazol-2-yl)-3-(3,4-dimethylphenyl)urea 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-(5-Benzhydryl-1,3,4-thiadiazol-2-yl)-3-(3,4-dimethylphenyl)urea?
The CAS number of 1-(5-Benzhydryl-1,3,4-thiadiazol-2-yl)-3-(3,4-dimethylphenyl)urea is 429628-51-3.
What is the molecular formula of 1-(5-Benzhydryl-1,3,4-thiadiazol-2-yl)-3-(3,4-dimethylphenyl)urea?
The molecular formula of 1-(5-Benzhydryl-1,3,4-thiadiazol-2-yl)-3-(3,4-dimethylphenyl)urea is C24H22N4OS.
What is the molecular weight of 1-(5-Benzhydryl-1,3,4-thiadiazol-2-yl)-3-(3,4-dimethylphenyl)urea?
The molecular weight of 1-(5-Benzhydryl-1,3,4-thiadiazol-2-yl)-3-(3,4-dimethylphenyl)urea is 414.15 g/mol.
Where can I buy 1-(5-Benzhydryl-1,3,4-thiadiazol-2-yl)-3-(3,4-dimethylphenyl)urea?
You can request a quote for 1-(5-Benzhydryl-1,3,4-thiadiazol-2-yl)-3-(3,4-dimethylphenyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-Benzhydryl-1,3,4-thiadiazol-2-yl)-3-(3,4-dimethylphenyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-Benzhydryl-1,3,4-thiadiazol-2-yl)-3-(3,4-dimethylphenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.