Urea, N-phenyl-N'-1,3,4-thiadiazol-2-yl-
TL;DR: Urea, N-phenyl-N'-1,3,4-thiadiazol-2-yl- (CAS 41118-83-6) is a chemical compound with molecular formula C9H8N4OS and molecular weight 220.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-3-(1,3,4-thiadiazol-2-yl)urea
Also Known As: THIDIAZURON, 1-phenyl-3-(1,3,4-thiadiazol-2-yl)urea, Urea, N-phenyl-N'-1,3,4-thiadiazol-2-yl-, N-Phenyl-N'-1,3,4-thiadiazol-2-ylurea, 1-Phenyl-3-[1,3,4]thiadiazol-2-yl-urea
| Molecular Formula | C9H8N4OS |
|---|---|
| Molecular Weight | 220.04 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 95.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 220.04189 |
| Heavy Atoms | 15 |
| Complexity | 220.0 |
Chemical Identifiers
| CAS Number | 41118-83-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)NC2=NN=CS2 |
| InChIKey | GFFHLIHHQYTOFL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Urea, N-phenyl-N'-1,3,4-thiadiazol-2-yl- (CAS 41118-83-6), with molecular formula C9H8N4OS and molecular weight 220.04 g/mol. IUPAC: 1-phenyl-3-(1,3,4-thiadiazol-2-yl)urea.
Chemical Property Profile of Urea, N-phenyl-N'-1,3,4-thiadiazol-2-yl-
Property Insights of Urea, N-phenyl-N'-1,3,4-thiadiazol-2-yl-
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, N-phenyl-N'-1,3,4-thiadiazol-2-yl-. The TPSA of 95.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Urea, N-phenyl-N'-1,3,4-thiadiazol-2-yl-. Following Lipinski's Rule of Five, Urea, N-phenyl-N'-1,3,4-thiadiazol-2-yl- has 2 hydrogen bond donor(s) and 4 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 Urea, N-phenyl-N'-1,3,4-thiadiazol-2-yl-?
The CAS number of Urea, N-phenyl-N'-1,3,4-thiadiazol-2-yl- is 41118-83-6.
What is the molecular formula of Urea, N-phenyl-N'-1,3,4-thiadiazol-2-yl-?
The molecular formula of Urea, N-phenyl-N'-1,3,4-thiadiazol-2-yl- is C9H8N4OS.
What is the molecular weight of Urea, N-phenyl-N'-1,3,4-thiadiazol-2-yl-?
The molecular weight of Urea, N-phenyl-N'-1,3,4-thiadiazol-2-yl- is 220.04 g/mol.
Where can I buy Urea, N-phenyl-N'-1,3,4-thiadiazol-2-yl-?
You can request a quote for Urea, N-phenyl-N'-1,3,4-thiadiazol-2-yl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, N-phenyl-N'-1,3,4-thiadiazol-2-yl-?
Yes, KEHONG BIO provides custom synthesis services for Urea, N-phenyl-N'-1,3,4-thiadiazol-2-yl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.