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2-Isobutyl-6-phenylimidazo[2,1-b][1,3,4]thiadiazole
TL;DR: 2-Isobutyl-6-phenylimidazo[2,1-b][1,3,4]thiadiazole (CAS 692744-75-5) is a chemical compound with molecular formula C14H15N3S and molecular weight 257.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-methylpropyl)-6-phenylimidazo[2,1-b][1,3,4]thiadiazole
Also Known As: 2-Isobutyl-6-phenylimidazo[2,1-b][1,3,4]thiadiazole, 2-(2-methylpropyl)-6-phenylimidazo[2,1-b][1,3,4]thiadiazole
| Molecular Formula | C14H15N3S |
|---|---|
| Molecular Weight | 257.10 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 58.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 257.09866 |
| Heavy Atoms | 18 |
| Complexity | 278.0 |
Chemical Identifiers
| CAS Number | 692744-75-5 |
|---|---|
| SMILES | CC(C)CC1=NN2C=C(N=C2S1)C3=CC=CC=C3 |
| InChIKey | HYAHKKPXCZWKAE-UHFFFAOYSA-N |
Product Overview
2-Isobutyl-6-phenylimidazo[2,1-b][1,3,4]thiadiazole (CAS 692744-75-5), with molecular formula C14H15N3S and molecular weight 257.10 g/mol. IUPAC: 2-(2-methylpropyl)-6-phenylimidazo[2,1-b][1,3,4]thiadiazole.
Chemical Property Profile of 2-Isobutyl-6-phenylimidazo[2,1-b][1,3,4]thiadiazole
Property Insights of 2-Isobutyl-6-phenylimidazo[2,1-b][1,3,4]thiadiazole
The XLogP value of 4.1 indicates that 2-Isobutyl-6-phenylimidazo[2,1-b][1,3,4]thiadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.4 Ų, 2-Isobutyl-6-phenylimidazo[2,1-b][1,3,4]thiadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Isobutyl-6-phenylimidazo[2,1-b][1,3,4]thiadiazole has 0 hydrogen bond donor(s) and 3 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-Isobutyl-6-phenylimidazo[2,1-b][1,3,4]thiadiazole?
The CAS number of 2-Isobutyl-6-phenylimidazo[2,1-b][1,3,4]thiadiazole is 692744-75-5.
What is the molecular formula of 2-Isobutyl-6-phenylimidazo[2,1-b][1,3,4]thiadiazole?
The molecular formula of 2-Isobutyl-6-phenylimidazo[2,1-b][1,3,4]thiadiazole is C14H15N3S.
What is the molecular weight of 2-Isobutyl-6-phenylimidazo[2,1-b][1,3,4]thiadiazole?
The molecular weight of 2-Isobutyl-6-phenylimidazo[2,1-b][1,3,4]thiadiazole is 257.10 g/mol.
Where can I buy 2-Isobutyl-6-phenylimidazo[2,1-b][1,3,4]thiadiazole?
You can request a quote for 2-Isobutyl-6-phenylimidazo[2,1-b][1,3,4]thiadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Isobutyl-6-phenylimidazo[2,1-b][1,3,4]thiadiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-Isobutyl-6-phenylimidazo[2,1-b][1,3,4]thiadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.