N-(5-heptyl-1,3,4-thiadiazol-2-yl)benzamide
TL;DR: N-(5-heptyl-1,3,4-thiadiazol-2-yl)benzamide (CAS 331818-29-2) is a chemical compound with molecular formula C16H21N3OS and molecular weight 303.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-heptyl-1,3,4-thiadiazol-2-yl)benzamide
Also Known As: N-(5-heptyl-1,3,4-thiadiazol-2-yl)benzamide, BAS 00599087, N-(5-heptyl(1,3,4-thiadiazol-2-yl))benzamide, N-(5-Heptyl-[1,3,4]thiadiazol-2-yl)-benzamide
| Molecular Formula | C16H21N3OS |
|---|---|
| Molecular Weight | 303.14 g/mol |
| LogP | 4.3033 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 303.14053 |
| Heavy Atoms | 21 |
| Complexity | 553.65955 |
Chemical Identifiers
| CAS Number | 331818-29-2 |
|---|---|
| SMILES | CCCCCCCC1=NN=C(S1)NC(=O)C2=CC=CC=C2 |
Product Overview
N-(5-heptyl-1,3,4-thiadiazol-2-yl)benzamide (CAS 331818-29-2), with molecular formula C16H21N3OS and molecular weight 303.14 g/mol. IUPAC: N-(5-heptyl-1,3,4-thiadiazol-2-yl)benzamide.
Chemical Property Profile of N-(5-heptyl-1,3,4-thiadiazol-2-yl)benzamide
Property Insights of N-(5-heptyl-1,3,4-thiadiazol-2-yl)benzamide
The XLogP value of 4.3033 indicates that N-(5-heptyl-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-heptyl-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-heptyl-1,3,4-thiadiazol-2-yl)benzamide has 1 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 N-(5-heptyl-1,3,4-thiadiazol-2-yl)benzamide?
The CAS number of N-(5-heptyl-1,3,4-thiadiazol-2-yl)benzamide is 331818-29-2.
What is the molecular formula of N-(5-heptyl-1,3,4-thiadiazol-2-yl)benzamide?
The molecular formula of N-(5-heptyl-1,3,4-thiadiazol-2-yl)benzamide is C16H21N3OS.
What is the molecular weight of N-(5-heptyl-1,3,4-thiadiazol-2-yl)benzamide?
The molecular weight of N-(5-heptyl-1,3,4-thiadiazol-2-yl)benzamide is 303.14 g/mol.
Where can I buy N-(5-heptyl-1,3,4-thiadiazol-2-yl)benzamide?
You can request a quote for N-(5-heptyl-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-heptyl-1,3,4-thiadiazol-2-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(5-heptyl-1,3,4-thiadiazol-2-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.