N-(5-(benzylthio)-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide
TL;DR: N-(5-(benzylthio)-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide (CAS 154347-57-6) is a chemical compound with molecular formula C13H13N3OS2 and molecular weight 291.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide
Also Known As: IFLab1_001841, N-(5-(benzylthio)-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide, F0509-0738, N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide, N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]cyclopropanecarboxamide
| Molecular Formula | C13H13N3OS2 |
|---|---|
| Molecular Weight | 291.05 g/mol |
| LogP | 3.1789 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 291.05002 |
| Heavy Atoms | 19 |
| Complexity | 566.2771 |
Chemical Identifiers
| CAS Number | 154347-57-6 |
|---|---|
| SMILES | C1CC1C(=O)NC2=NN=C(S2)SCC3=CC=CC=C3 |
Product Overview
N-(5-(benzylthio)-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide (CAS 154347-57-6), with molecular formula C13H13N3OS2 and molecular weight 291.05 g/mol. IUPAC: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide.
Chemical Property Profile of N-(5-(benzylthio)-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide
Property Insights of N-(5-(benzylthio)-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide
The XLogP value of 3.1789 indicates that N-(5-(benzylthio)-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.88 Ų, N-(5-(benzylthio)-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(5-(benzylthio)-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide has 1 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 N-(5-(benzylthio)-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide?
The CAS number of N-(5-(benzylthio)-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide is 154347-57-6.
What is the molecular formula of N-(5-(benzylthio)-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide?
The molecular formula of N-(5-(benzylthio)-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide is C13H13N3OS2.
What is the molecular weight of N-(5-(benzylthio)-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide?
The molecular weight of N-(5-(benzylthio)-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide is 291.05 g/mol.
Where can I buy N-(5-(benzylthio)-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide?
You can request a quote for N-(5-(benzylthio)-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(5-(benzylthio)-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(5-(benzylthio)-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.