![3,5-Bis[(3-methoxyphenyl)methylsulfanyl]-1,2-thiazole-4-carbonitrile structure](/static/products/3092/309278-29-3.webp)
3,5-Bis[(3-methoxyphenyl)methylsulfanyl]-1,2-thiazole-4-carbonitrile
TL;DR: 3,5-Bis[(3-methoxyphenyl)methylsulfanyl]-1,2-thiazole-4-carbonitrile (CAS 309278-29-3) is a chemical compound with molecular formula C20H18N2O2S3 and molecular weight 414.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-bis[(3-methoxyphenyl)methylsulfanyl]-1,2-thiazole-4-carbonitrile
Also Known As: BAS 01100607, 3,5-bis[(3-methoxybenzyl)sulfanyl]-4-isothiazolecarbonitrile, 3,5-bis[(3-methoxyphenyl)methylsulfanyl]-1,2-thiazole-4-carbonitrile, AM-807/40394027, 3,5-bis((3-methoxybenzyl)thio)isothiazole-4-carbonitrile
| Molecular Formula | C20H18N2O2S3 |
|---|---|
| Molecular Weight | 414.05 g/mol |
| LogP | 5.61658 |
| Topological Polar Surface Area | 55.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 414.05304 |
| Heavy Atoms | 27 |
| Complexity | 881.395 |
Chemical Identifiers
| CAS Number | 309278-29-3 |
|---|---|
| SMILES | COC1=CC=CC(=C1)CSC2=C(C(=NS2)SCC3=CC(=CC=C3)OC)C#N |
Product Overview
3,5-Bis[(3-methoxyphenyl)methylsulfanyl]-1,2-thiazole-4-carbonitrile (CAS 309278-29-3), with molecular formula C20H18N2O2S3 and molecular weight 414.05 g/mol. IUPAC: 3,5-bis[(3-methoxyphenyl)methylsulfanyl]-1,2-thiazole-4-carbonitrile.
Chemical Property Profile of 3,5-Bis[(3-methoxyphenyl)methylsulfanyl]-1,2-thiazole-4-carbonitrile
Property Insights of 3,5-Bis[(3-methoxyphenyl)methylsulfanyl]-1,2-thiazole-4-carbonitrile
The XLogP value of 5.61658 indicates that 3,5-Bis[(3-methoxyphenyl)methylsulfanyl]-1,2-thiazole-4-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.14 Ų, 3,5-Bis[(3-methoxyphenyl)methylsulfanyl]-1,2-thiazole-4-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Bis[(3-methoxyphenyl)methylsulfanyl]-1,2-thiazole-4-carbonitrile has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,5-Bis[(3-methoxyphenyl)methylsulfanyl]-1,2-thiazole-4-carbonitrile?
The CAS number of 3,5-Bis[(3-methoxyphenyl)methylsulfanyl]-1,2-thiazole-4-carbonitrile is 309278-29-3.
What is the molecular formula of 3,5-Bis[(3-methoxyphenyl)methylsulfanyl]-1,2-thiazole-4-carbonitrile?
The molecular formula of 3,5-Bis[(3-methoxyphenyl)methylsulfanyl]-1,2-thiazole-4-carbonitrile is C20H18N2O2S3.
What is the molecular weight of 3,5-Bis[(3-methoxyphenyl)methylsulfanyl]-1,2-thiazole-4-carbonitrile?
The molecular weight of 3,5-Bis[(3-methoxyphenyl)methylsulfanyl]-1,2-thiazole-4-carbonitrile is 414.05 g/mol.
Where can I buy 3,5-Bis[(3-methoxyphenyl)methylsulfanyl]-1,2-thiazole-4-carbonitrile?
You can request a quote for 3,5-Bis[(3-methoxyphenyl)methylsulfanyl]-1,2-thiazole-4-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Bis[(3-methoxyphenyl)methylsulfanyl]-1,2-thiazole-4-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Bis[(3-methoxyphenyl)methylsulfanyl]-1,2-thiazole-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.