2-Butenediamide, N-1,3,4-thiadiazol-2-yl-
TL;DR: 2-Butenediamide, N-1,3,4-thiadiazol-2-yl- (CAS 90278-95-8) is a chemical compound with molecular formula C6H6N4O2S and molecular weight 198.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N'-(1,3,4-thiadiazol-2-yl)but-2-enediamide
Also Known As: N-1,3,4-Thiadiazol-2-yl-2-butenediamide, 2-BUTENEDIAMIDE, N-1,3,4-THIADIAZOL-2-YL-, (E)-N'-(1,3,4-thiadiazol-2-yl)but-2-enediamide, RefChem:1062580, BRN 5531564
| Molecular Formula | C6H6N4O2S |
|---|---|
| Molecular Weight | 198.02 g/mol |
| LogP | -0.4819 |
| Topological Polar Surface Area | 97.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 198.02115 |
| Heavy Atoms | 13 |
| Complexity | 332.41327 |
Chemical Identifiers
| CAS Number | 90278-95-8 |
|---|---|
| SMILES | C1=NN=C(S1)NC(=O)/C=C/C(=O)N |
Product Overview
2-Butenediamide, N-1,3,4-thiadiazol-2-yl- (CAS 90278-95-8), with molecular formula C6H6N4O2S and molecular weight 198.02 g/mol. IUPAC: (E)-N'-(1,3,4-thiadiazol-2-yl)but-2-enediamide.
Chemical Property Profile of 2-Butenediamide, N-1,3,4-thiadiazol-2-yl-
Property Insights of 2-Butenediamide, N-1,3,4-thiadiazol-2-yl-
The XLogP value of -0.4819 indicates that 2-Butenediamide, N-1,3,4-thiadiazol-2-yl- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 97.97 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Butenediamide, N-1,3,4-thiadiazol-2-yl-. Following Lipinski's Rule of Five, 2-Butenediamide, N-1,3,4-thiadiazol-2-yl- has 2 hydrogen bond donor(s) and 5 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 2-Butenediamide, N-1,3,4-thiadiazol-2-yl-?
The CAS number of 2-Butenediamide, N-1,3,4-thiadiazol-2-yl- is 90278-95-8.
What is the molecular formula of 2-Butenediamide, N-1,3,4-thiadiazol-2-yl-?
The molecular formula of 2-Butenediamide, N-1,3,4-thiadiazol-2-yl- is C6H6N4O2S.
What is the molecular weight of 2-Butenediamide, N-1,3,4-thiadiazol-2-yl-?
The molecular weight of 2-Butenediamide, N-1,3,4-thiadiazol-2-yl- is 198.02 g/mol.
Where can I buy 2-Butenediamide, N-1,3,4-thiadiazol-2-yl-?
You can request a quote for 2-Butenediamide, 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 2-Butenediamide, N-1,3,4-thiadiazol-2-yl-?
Yes, KEHONG BIO provides custom synthesis services for 2-Butenediamide, N-1,3,4-thiadiazol-2-yl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.