![N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide structure](/static/products/5521/55217-83-9.webp)
N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide
TL;DR: N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide (CAS 55217-83-9) is a chemical compound with molecular formula C16H13N3OS2 and molecular weight 327.05 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)benzamide
Also Known As: N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide, N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide, J1.524.533F, N-(5-(benzylthio)-1,3,4-thiadiazol-2-yl)benzamide, N-[5-(Benzylthio)-1,3,4-thiadiazole-2-yl]benzamide
| Molecular Formula | C16H13N3OS2 |
|---|---|
| Molecular Weight | 327.05 g/mol |
| LogP | 4.0827 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 327.05002 |
| Heavy Atoms | 22 |
| Complexity | 744.35205 |
Chemical Identifiers
| CAS Number | 55217-83-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)C3=CC=CC=C3 |
Product Overview
N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide (CAS 55217-83-9), with molecular formula C16H13N3OS2 and molecular weight 327.05 g/mol. IUPAC: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide.
Chemical Property Profile of N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide
Property Insights of N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide
The XLogP value of 4.0827 indicates that N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide 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-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide 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-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide?
The CAS number of N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide is 55217-83-9.
What is the molecular formula of N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide?
The molecular formula of N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide is C16H13N3OS2.
What is the molecular weight of N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide?
The molecular weight of N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide is 327.05 g/mol.
Where can I buy N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide?
You can request a quote for N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.