A2936/0123607
TL;DR: A2936/0123607 (CAS 488705-48-2) is a chemical compound with molecular formula C23H19N3OS6 and molecular weight 544.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4,4,8-trimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)ethanone
Also Known As: A2936/0123607, 2-[(4-phenyl-5-thioxo-4,5-dihydro-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4,4,8-trimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)ethanone, 2-((4-phenyl-5-thioxo-4,5-dihydro-1,3,4-thiadiazol-2-yl)thio)-1-(4,4,8-trimethyl-1-thioxo-1H-[1,2]dithiolo[3,4-c]quinolin-5(4H)-yl)ethanone, 2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4,4,8-trimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)ethanone, 2-[(4-PHENYL-5-SULFANYLIDENE-4,5-DIHYDRO-1,3,4-THIADIAZOL-2-YL)SULFANYL]-1-{4,4,8-TRIMETHYL-1-SULFANYLIDENE-1H,4H,5H-[1,2]DITHIOLO[3,4-C]QUINOLIN-5-YL}ETHAN-1-ONE
| Molecular Formula | C23H19N3OS6 |
|---|---|
| Molecular Weight | 544.99 g/mol |
| LogP | 7.8652 |
| Topological Polar Surface Area | 38.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 544.9852 |
| Heavy Atoms | 33 |
| Complexity | 1477.8424 |
Chemical Identifiers
| CAS Number | 488705-48-2 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N(C(C3=C2C(=S)SS3)(C)C)C(=O)CSC4=NN(C(=S)S4)C5=CC=CC=C5 |
Product Overview
A2936/0123607 (CAS 488705-48-2), with molecular formula C23H19N3OS6 and molecular weight 544.99 g/mol. IUPAC: 2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4,4,8-trimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)ethanone.
Chemical Property Profile of A2936/0123607
Property Insights of A2936/0123607
The XLogP value of 7.8652 indicates that A2936/0123607 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.13 Ų, A2936/0123607 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A2936/0123607 has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A2936/0123607?
The CAS number of A2936/0123607 is 488705-48-2.
What is the molecular formula of A2936/0123607?
The molecular formula of A2936/0123607 is C23H19N3OS6.
What is the molecular weight of A2936/0123607?
The molecular weight of A2936/0123607 is 544.99 g/mol.
Where can I buy A2936/0123607?
You can request a quote for A2936/0123607 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2936/0123607?
Yes, KEHONG BIO provides custom synthesis services for A2936/0123607 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.