Bionet1_004869
TL;DR: Bionet1_004869 (CAS 439107-25-2) is a chemical compound with molecular formula C24H22N2S and molecular weight 370.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-methylphenyl)-3-[(4-methylphenyl)methylsulfanyl]-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile
Also Known As: Bionet1_004869, 3-[(4-methylbenzyl)sulfanyl]-1-(2-methylphenyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile, 3T-0225, 1-(2-methylphenyl)-3-[(4-methylphenyl)methylsulfanyl]-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile, 1-(2-methylphenyl)-3-{[(4-methylphenyl)methyl]sulfanyl}-5H,6H,7H-cyclopenta[c]pyridine-4-carbonitrile
| Molecular Formula | C24H22N2S |
|---|---|
| Molecular Weight | 370.15 g/mol |
| LogP | 6.01812 |
| Topological Polar Surface Area | 36.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 370.15036 |
| Heavy Atoms | 27 |
| Complexity | 1029.4822 |
Chemical Identifiers
| CAS Number | 439107-25-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CSC2=C(C3=C(CCC3)C(=N2)C4=CC=CC=C4C)C#N |
Product Overview
Bionet1_004869 (CAS 439107-25-2), with molecular formula C24H22N2S and molecular weight 370.15 g/mol. IUPAC: 1-(2-methylphenyl)-3-[(4-methylphenyl)methylsulfanyl]-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile.
Chemical Property Profile of Bionet1_004869
Property Insights of Bionet1_004869
The XLogP value of 6.01812 indicates that Bionet1_004869 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.68 Ų, Bionet1_004869 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bionet1_004869 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 Bionet1_004869?
The CAS number of Bionet1_004869 is 439107-25-2.
What is the molecular formula of Bionet1_004869?
The molecular formula of Bionet1_004869 is C24H22N2S.
What is the molecular weight of Bionet1_004869?
The molecular weight of Bionet1_004869 is 370.15 g/mol.
Where can I buy Bionet1_004869?
You can request a quote for Bionet1_004869 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_004869?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_004869 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.