ChemDiv1_022820
TL;DR: ChemDiv1_022820 (CAS 351191-97-4) is a chemical compound with molecular formula C23H29NOS3 and molecular weight 431.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-cyclohexyl-1-(4,4,7,8-tetramethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)propan-1-one
Also Known As: ChemDiv1_022820, DivK1c_004084, CDS1_003044, BAS 01045185, 3-cyclohexyl-1-(4,4,7,8-tetramethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)propan-1-one
| Molecular Formula | C23H29NOS3 |
|---|---|
| Molecular Weight | 431.14 g/mol |
| LogP | 7.76513 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 431.1411 |
| Heavy Atoms | 28 |
| Complexity | 962.71246 |
Chemical Identifiers
| CAS Number | 351191-97-4 |
|---|---|
| SMILES | CC1=CC2=C(C=C1C)N(C(C3=C2C(=S)SS3)(C)C)C(=O)CCC4CCCCC4 |
Product Overview
ChemDiv1_022820 (CAS 351191-97-4), with molecular formula C23H29NOS3 and molecular weight 431.14 g/mol. IUPAC: 3-cyclohexyl-1-(4,4,7,8-tetramethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)propan-1-one.
Chemical Property Profile of ChemDiv1_022820
Property Insights of ChemDiv1_022820
The XLogP value of 7.76513 indicates that ChemDiv1_022820 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.31 Ų, ChemDiv1_022820 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_022820 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_022820?
The CAS number of ChemDiv1_022820 is 351191-97-4.
What is the molecular formula of ChemDiv1_022820?
The molecular formula of ChemDiv1_022820 is C23H29NOS3.
What is the molecular weight of ChemDiv1_022820?
The molecular weight of ChemDiv1_022820 is 431.14 g/mol.
Where can I buy ChemDiv1_022820?
You can request a quote for ChemDiv1_022820 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_022820?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_022820 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.