J1.315.433C
TL;DR: J1.315.433C (CAS 142743-87-1) is a chemical compound with molecular formula C40H46N3S+ and molecular weight 600.34125 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(6E)-2-[(E)-2-(1-ethyl-3,3-dimethylindol-1-ium-2-yl)ethenyl]-6-[(2E)-2-(1-ethyl-3,3-dimethylindol-2-ylidene)ethylidene]cyclohexen-1-yl]sulfanylaniline
Also Known As: J1.315.433C, 2-(2-(2-((4-Aminophenyl)thio)-3-(2-(1-ethyl-3,3-dimethylindolin-2-ylidene)ethylidene)cyclohex-1-en-1-yl)vinyl)-1-ethyl-3,3-dimethyl-3H-indol-1-ium, 1-Ethyl-2-[(E)-2-[2-(4-aminophenylthio)-3-[(E)-2-[(2E)-(1-ethyl-3,3-dimethyl-2,3-dihydro-1H-indole)-2-ylidene]ethylidene]-1-cyclohexenyl]ethenyl]-3,3-dimethyl-3H-indole-1-ium, 2-[(1E)-2-[(3E)-2-[(4-aminophenyl)sulfanyl]-3-{2-[(2E)-1-ethyl-3,3-dimethyl-2,3-dihydro-1H-indol-2-ylidene]ethylidene}cyclohex-1-en-1-yl]ethenyl]-1-ethyl-3,3-dimethyl-3H-indol-1-ium
Technical Specifications
| Molecular Formula | C40H46N3S+ |
| Molecular Weight | 600.34125 g/mol |
| XLogP | 8.9 |
| Topological Polar Surface Area (TPSA) | 57.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 600.34125 Da |
| Heavy Atoms | 44 |
| Complexity | 1130.0 |
| SMILES | CCN\1C2=CC=CC=C2C(/C1=C\C=C\3/CCCC(=C3SC4=CC=C(C=C4)N)/C=C/C5=[N+](C6=CC=CC=C6C5(C)C)CC)(C)C |
| InChIKey | YWOYQASSPBQRCK-UHFFFAOYSA-N |
Chemical Property Profile of J1.315.433C
Property Insights of J1.315.433C
The XLogP value of 8.9 indicates that J1.315.433C is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.6 Ų, J1.315.433C exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, J1.315.433C has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of J1.315.433C?
The CAS number of J1.315.433C is 142743-87-1.
What is the molecular formula of J1.315.433C?
The molecular formula of J1.315.433C is C40H46N3S+.
What is the molecular weight of J1.315.433C?
The molecular weight of J1.315.433C is 600.34125 g/mol.
Where can I buy J1.315.433C?
You can request a quote for J1.315.433C directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for J1.315.433C?
Yes, CoreyChem provides custom synthesis services for J1.315.433C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.