N-(5-(isopropylthio)-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide
TL;DR: N-(5-(isopropylthio)-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide (CAS 477212-35-4) is a chemical compound with molecular formula C14H17N3OS2 and molecular weight 307.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenyl-N-(5-propan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)propanamide
Also Known As: N-(5-(isopropylthio)-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide, 3-phenyl-N-[5-(propan-2-ylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide, F0529-0835, 3-phenyl-N-(5-propan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)propanamide
| Molecular Formula | C14H17N3OS2 |
|---|---|
| Molecular Weight | 307.08 g/mol |
| LogP | 3.6099 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 307.0813 |
| Heavy Atoms | 20 |
| Complexity | 554.55646 |
Chemical Identifiers
| CAS Number | 477212-35-4 |
|---|---|
| SMILES | CC(C)SC1=NN=C(S1)NC(=O)CCC2=CC=CC=C2 |
Product Overview
N-(5-(isopropylthio)-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide (CAS 477212-35-4), with molecular formula C14H17N3OS2 and molecular weight 307.08 g/mol. IUPAC: 3-phenyl-N-(5-propan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)propanamide.
Chemical Property Profile of N-(5-(isopropylthio)-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide
Property Insights of N-(5-(isopropylthio)-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide
The XLogP value of 3.6099 indicates that N-(5-(isopropylthio)-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide 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-(isopropylthio)-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(5-(isopropylthio)-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide 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-(isopropylthio)-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide?
The CAS number of N-(5-(isopropylthio)-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide is 477212-35-4.
What is the molecular formula of N-(5-(isopropylthio)-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide?
The molecular formula of N-(5-(isopropylthio)-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide is C14H17N3OS2.
What is the molecular weight of N-(5-(isopropylthio)-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide?
The molecular weight of N-(5-(isopropylthio)-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide is 307.08 g/mol.
Where can I buy N-(5-(isopropylthio)-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide?
You can request a quote for N-(5-(isopropylthio)-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(5-(isopropylthio)-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(5-(isopropylthio)-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.