5-Benzyl-2-(4-methoxyphenyl)-2,3-dihydro-1,3,4-thiadiazole
TL;DR: 5-Benzyl-2-(4-methoxyphenyl)-2,3-dihydro-1,3,4-thiadiazole (CAS 90057-59-3) is a chemical compound with molecular formula C16H16N2OS and molecular weight 284.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-benzyl-2-(4-methoxyphenyl)-2,3-dihydro-1,3,4-thiadiazole
Also Known As: UDFIBZFTDDZRKT-UHFFFAOYSA, UDFIBZFTDDZRKT-UHFFFAOYSA-, 5-benzyl-2-(4-methoxyphenyl)-2,3-dihydro-1,3,4-thiadiazole, BIM-0027944.P001, AB00093296-01
| Molecular Formula | C16H16N2OS |
|---|---|
| Molecular Weight | 284.10 g/mol |
| LogP | 3.5864 |
| Topological Polar Surface Area | 33.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 284.09833 |
| Heavy Atoms | 20 |
| Complexity | 595.6337 |
Chemical Identifiers
| CAS Number | 90057-59-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2NN=C(S2)CC3=CC=CC=C3 |
Product Overview
5-Benzyl-2-(4-methoxyphenyl)-2,3-dihydro-1,3,4-thiadiazole (CAS 90057-59-3), with molecular formula C16H16N2OS and molecular weight 284.10 g/mol. IUPAC: 5-benzyl-2-(4-methoxyphenyl)-2,3-dihydro-1,3,4-thiadiazole.
Chemical Property Profile of 5-Benzyl-2-(4-methoxyphenyl)-2,3-dihydro-1,3,4-thiadiazole
Property Insights of 5-Benzyl-2-(4-methoxyphenyl)-2,3-dihydro-1,3,4-thiadiazole
The XLogP value of 3.5864 indicates that 5-Benzyl-2-(4-methoxyphenyl)-2,3-dihydro-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 33.62 Ų, 5-Benzyl-2-(4-methoxyphenyl)-2,3-dihydro-1,3,4-thiadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Benzyl-2-(4-methoxyphenyl)-2,3-dihydro-1,3,4-thiadiazole 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 5-Benzyl-2-(4-methoxyphenyl)-2,3-dihydro-1,3,4-thiadiazole?
The CAS number of 5-Benzyl-2-(4-methoxyphenyl)-2,3-dihydro-1,3,4-thiadiazole is 90057-59-3.
What is the molecular formula of 5-Benzyl-2-(4-methoxyphenyl)-2,3-dihydro-1,3,4-thiadiazole?
The molecular formula of 5-Benzyl-2-(4-methoxyphenyl)-2,3-dihydro-1,3,4-thiadiazole is C16H16N2OS.
What is the molecular weight of 5-Benzyl-2-(4-methoxyphenyl)-2,3-dihydro-1,3,4-thiadiazole?
The molecular weight of 5-Benzyl-2-(4-methoxyphenyl)-2,3-dihydro-1,3,4-thiadiazole is 284.10 g/mol.
Where can I buy 5-Benzyl-2-(4-methoxyphenyl)-2,3-dihydro-1,3,4-thiadiazole?
You can request a quote for 5-Benzyl-2-(4-methoxyphenyl)-2,3-dihydro-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 5-Benzyl-2-(4-methoxyphenyl)-2,3-dihydro-1,3,4-thiadiazole?
Yes, KEHONG BIO provides custom synthesis services for 5-Benzyl-2-(4-methoxyphenyl)-2,3-dihydro-1,3,4-thiadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.