CAS 127654-19-7 - C20H22N2O2S
TL;DR: CAS 127654-19-7 - C20H22N2O2S (CAS 127654-19-7) is a chemical compound with molecular formula C20H22N2O2S and molecular weight 354.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(5-methylsulfanyl-5,6-dihydropyrido[3,4-c][1]benzazepin-11-ylidene)hexanoic acid
Also Known As: 6-(10,11-Dihydro-11-(methylthio)-5H-pyrido(3,4-c)(1)benzazepin-5-ylidene)hexanoic acid
| Molecular Formula | C20H22N2O2S |
|---|---|
| Molecular Weight | 354.14 g/mol |
| LogP | 4.9454 |
| Topological Polar Surface Area | 62.22 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 354.1402 |
| Heavy Atoms | 25 |
| Complexity | 788.77057 |
Chemical Identifiers
| CAS Number | 127654-19-7 |
|---|---|
| SMILES | CSC1C2=C(C=CN=C2)C(=CCCCCC(=O)O)C3=CC=CC=C3N1 |
Product Overview
CAS 127654-19-7 - C20H22N2O2S (CAS 127654-19-7), with molecular formula C20H22N2O2S and molecular weight 354.14 g/mol. IUPAC: 6-(5-methylsulfanyl-5,6-dihydropyrido[3,4-c][1]benzazepin-11-ylidene)hexanoic acid.
Chemical Property Profile of CAS 127654-19-7 - C20H22N2O2S
Property Insights of CAS 127654-19-7 - C20H22N2O2S
The XLogP value of 4.9454 indicates that CAS 127654-19-7 - C20H22N2O2S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.22 Ų falls within the moderate polarity range, balancing permeability and solubility for CAS 127654-19-7 - C20H22N2O2S. Following Lipinski's Rule of Five, CAS 127654-19-7 - C20H22N2O2S has 2 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 CAS 127654-19-7 - C20H22N2O2S?
The CAS number of CAS 127654-19-7 - C20H22N2O2S is 127654-19-7.
What is the molecular formula of CAS 127654-19-7 - C20H22N2O2S?
The molecular formula of CAS 127654-19-7 - C20H22N2O2S is C20H22N2O2S.
What is the molecular weight of CAS 127654-19-7 - C20H22N2O2S?
The molecular weight of CAS 127654-19-7 - C20H22N2O2S is 354.14 g/mol.
Where can I buy CAS 127654-19-7 - C20H22N2O2S?
You can request a quote for CAS 127654-19-7 - C20H22N2O2S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CAS 127654-19-7 - C20H22N2O2S?
Yes, KEHONG BIO provides custom synthesis services for CAS 127654-19-7 - C20H22N2O2S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.