starbld0002879
TL;DR: starbld0002879 (CAS 878616-83-2) is a chemical compound with molecular formula C16H22N2O3S and molecular weight 322.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(4-methylcyclohexyl)amino]-2-oxoethyl] 2-methylsulfanylpyridine-3-carboxylate
Also Known As: starbld0002879, [2-[(4-methylcyclohexyl)amino]-2-oxoethyl] 2-methylsulfanylpyridine-3-carboxylate, 2-((4-Methylcyclohexyl)amino)-2-oxoethyl 2-(methylthio)nicotinate, [(4-methylcyclohexyl)carbamoyl]methyl 2-(methylsulfanyl)pyridine-3-carboxylate, 2-[(4-Methylcyclohexyl)amino]-2-oxoethyl 2-(methylsulfanyl)pyridine-3-carboxylate
| Molecular Formula | C16H22N2O3S |
|---|---|
| Molecular Weight | 322.14 g/mol |
| LogP | 2.6552 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 322.1351 |
| Heavy Atoms | 22 |
| Complexity | 527.87714 |
Chemical Identifiers
| CAS Number | 878616-83-2 |
|---|---|
| SMILES | CC1CCC(CC1)NC(=O)COC(=O)C2=C(N=CC=C2)SC |
Product Overview
starbld0002879 (CAS 878616-83-2), with molecular formula C16H22N2O3S and molecular weight 322.14 g/mol. IUPAC: [2-[(4-methylcyclohexyl)amino]-2-oxoethyl] 2-methylsulfanylpyridine-3-carboxylate.
Chemical Property Profile of starbld0002879
Property Insights of starbld0002879
The XLogP value of 2.6552 suggests moderate lipophilicity, balancing water solubility and membrane permeability for starbld0002879. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for starbld0002879. Following Lipinski's Rule of Five, starbld0002879 has 1 hydrogen bond donor(s) and 5 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 starbld0002879?
The CAS number of starbld0002879 is 878616-83-2.
What is the molecular formula of starbld0002879?
The molecular formula of starbld0002879 is C16H22N2O3S.
What is the molecular weight of starbld0002879?
The molecular weight of starbld0002879 is 322.14 g/mol.
Where can I buy starbld0002879?
You can request a quote for starbld0002879 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for starbld0002879?
Yes, KEHONG BIO provides custom synthesis services for starbld0002879 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.