5-[(Phenylcarbamoyl)amino]-1,3,4-thiadiazole-2-sulfonamide
TL;DR: 5-[(Phenylcarbamoyl)amino]-1,3,4-thiadiazole-2-sulfonamide (CAS 109907-75-7) is a chemical compound with molecular formula C9H9N5O3S2 and molecular weight 299.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-3-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)urea
Also Known As: 1-phenyl-3-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)urea, 5-(N'-phenylureido)-1,3,4-thiadiazole-2-sulfonamide, 5-(3-Phenylureido)-1,3,4-thiadiazole-2-sulfonamide, 5-[(Phenylcarbamoyl)amino]-1,3,4-thiadiazole-2-sulfonamide, 1,3,4-Thiadiazole-2-sulfonamide, 5-[[(phenylamino)carbonyl]amino]-
| Molecular Formula | C9H9N5O3S2 |
|---|---|
| Molecular Weight | 299.01 g/mol |
| LogP | 0.8295 |
| Topological Polar Surface Area | 127.07 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 299.01468 |
| Heavy Atoms | 19 |
| Complexity | 682.89044 |
Chemical Identifiers
| CAS Number | 109907-75-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)NC2=NN=C(S2)S(=O)(=O)N |
Product Overview
5-[(Phenylcarbamoyl)amino]-1,3,4-thiadiazole-2-sulfonamide (CAS 109907-75-7), with molecular formula C9H9N5O3S2 and molecular weight 299.01 g/mol. IUPAC: 1-phenyl-3-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)urea.
Chemical Property Profile of 5-[(Phenylcarbamoyl)amino]-1,3,4-thiadiazole-2-sulfonamide
Property Insights of 5-[(Phenylcarbamoyl)amino]-1,3,4-thiadiazole-2-sulfonamide
The XLogP value of 0.8295 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(Phenylcarbamoyl)amino]-1,3,4-thiadiazole-2-sulfonamide. The TPSA of 127.07 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(Phenylcarbamoyl)amino]-1,3,4-thiadiazole-2-sulfonamide. Following Lipinski's Rule of Five, 5-[(Phenylcarbamoyl)amino]-1,3,4-thiadiazole-2-sulfonamide has 3 hydrogen bond donor(s) and 6 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 5-[(Phenylcarbamoyl)amino]-1,3,4-thiadiazole-2-sulfonamide?
The CAS number of 5-[(Phenylcarbamoyl)amino]-1,3,4-thiadiazole-2-sulfonamide is 109907-75-7.
What is the molecular formula of 5-[(Phenylcarbamoyl)amino]-1,3,4-thiadiazole-2-sulfonamide?
The molecular formula of 5-[(Phenylcarbamoyl)amino]-1,3,4-thiadiazole-2-sulfonamide is C9H9N5O3S2.
What is the molecular weight of 5-[(Phenylcarbamoyl)amino]-1,3,4-thiadiazole-2-sulfonamide?
The molecular weight of 5-[(Phenylcarbamoyl)amino]-1,3,4-thiadiazole-2-sulfonamide is 299.01 g/mol.
Where can I buy 5-[(Phenylcarbamoyl)amino]-1,3,4-thiadiazole-2-sulfonamide?
You can request a quote for 5-[(Phenylcarbamoyl)amino]-1,3,4-thiadiazole-2-sulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(Phenylcarbamoyl)amino]-1,3,4-thiadiazole-2-sulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 5-[(Phenylcarbamoyl)amino]-1,3,4-thiadiazole-2-sulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.