3T-0326
TL;DR: 3T-0326 (CAS 439107-40-1) is a chemical compound with molecular formula C24H20Cl2N2S and molecular weight 438.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(3,4-dichlorophenyl)methylsulfanyl]-1-(3-methylphenyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Also Known As: 3T-0326, 3-[(3,4-dichlorobenzyl)sulfanyl]-1-(3-methylphenyl)-5,6,7,8-tetrahydro-4-isoquinolinecarbonitrile, 3-[(3,4-dichlorophenyl)methylsulfanyl]-1-(3-methylphenyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile, 3-{[(3,4-dichlorophenyl)methyl]sulfanyl}-1-(3-methylphenyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
| Molecular Formula | C24H20Cl2N2S |
|---|---|
| Molecular Weight | 438.07 g/mol |
| LogP | 7.4066 |
| Topological Polar Surface Area | 36.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 438.07242 |
| Heavy Atoms | 29 |
| Complexity | 1118.594 |
Chemical Identifiers
| CAS Number | 439107-40-1 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C2=NC(=C(C3=C2CCCC3)C#N)SCC4=CC(=C(C=C4)Cl)Cl |
Product Overview
3T-0326 (CAS 439107-40-1), with molecular formula C24H20Cl2N2S and molecular weight 438.07 g/mol. IUPAC: 3-[(3,4-dichlorophenyl)methylsulfanyl]-1-(3-methylphenyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile.
Chemical Property Profile of 3T-0326
Property Insights of 3T-0326
The XLogP value of 7.4066 indicates that 3T-0326 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.68 Ų, 3T-0326 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3T-0326 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3T-0326?
The CAS number of 3T-0326 is 439107-40-1.
What is the molecular formula of 3T-0326?
The molecular formula of 3T-0326 is C24H20Cl2N2S.
What is the molecular weight of 3T-0326?
The molecular weight of 3T-0326 is 438.07 g/mol.
Where can I buy 3T-0326?
You can request a quote for 3T-0326 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3T-0326?
Yes, KEHONG BIO provides custom synthesis services for 3T-0326 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.