2T-0334
TL;DR: 2T-0334 (CAS 439096-75-0) is a chemical compound with molecular formula C18H15N3S and molecular weight 305.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(cyanomethylsulfanyl)-1-(2-methylphenyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile
Also Known As: 2T-0334, 3-[(cyanomethyl)sulfanyl]-1-(2-methylphenyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile, 3-(cyanomethylsulfanyl)-1-(2-methylphenyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile, 3-[(cyanomethyl)sulfanyl]-1-(2-methylphenyl)-5H,6H,7H-cyclopenta[c]pyridine-4-carbonitrile
| Molecular Formula | C18H15N3S |
|---|---|
| Molecular Weight | 305.10 g/mol |
| LogP | 4.03308 |
| Topological Polar Surface Area | 60.47 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 305.09866 |
| Heavy Atoms | 22 |
| Complexity | 812.3027 |
Chemical Identifiers
| CAS Number | 439096-75-0 |
|---|---|
| SMILES | CC1=CC=CC=C1C2=NC(=C(C3=C2CCC3)C#N)SCC#N |
Product Overview
2T-0334 (CAS 439096-75-0), with molecular formula C18H15N3S and molecular weight 305.10 g/mol. IUPAC: 3-(cyanomethylsulfanyl)-1-(2-methylphenyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile.
Chemical Property Profile of 2T-0334
Property Insights of 2T-0334
The XLogP value of 4.03308 indicates that 2T-0334 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 2T-0334. Following Lipinski's Rule of Five, 2T-0334 has 0 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 2T-0334?
The CAS number of 2T-0334 is 439096-75-0.
What is the molecular formula of 2T-0334?
The molecular formula of 2T-0334 is C18H15N3S.
What is the molecular weight of 2T-0334?
The molecular weight of 2T-0334 is 305.10 g/mol.
Where can I buy 2T-0334?
You can request a quote for 2T-0334 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2T-0334?
Yes, KEHONG BIO provides custom synthesis services for 2T-0334 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.