EINECS 246-410-5
TL;DR: EINECS 246-410-5 (CAS 24687-33-0) is a chemical compound with molecular formula C31H28N2O3S3 and molecular weight 572.1262 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[2-[2-[(1-methylbenzo[e][1,3]benzothiazol-1-ium-2-yl)methylidene]butylidene]benzo[e][1,3]benzothiazol-1-yl]propane-1-sulfonate
Also Known As: 4-Piperidinol,3-ethyl-2,6-diphenyl, 2-(2-((1-Methylnaphtho(1,2-d)thiazol-2(1H)-ylidene)methyl)-1-butenyl)-1-(3-sulphonatopropyl)naphtho(1,2-d)thiazolium, 3-[2-[2-[(1-methylbenzo[e][1,3]benzothiazol-1-ium-2-yl)methylidene]butylidene]benzo[e][1,3]benzothiazol-1-yl]propane-1-sulfonate, 2-[2-[(1-Methylnaphtho[1,2-d]thiazol-2(1H)-ylidene)methyl]-1-butenyl]-1-(3-sulfonatopropyl)naphtho[1,2-d]thiazolium, 2-[2-[(1-methylnaphtho[1,2-d]thiazol-2(1H)-ylidene)methyl]-1-butenyl]-1-(3-sulphonatopropyl)naphtho[1,2-d]thiazolium
Technical Specifications
| Molecular Formula | C31H28N2O3S3 |
| Molecular Weight | 572.1262 g/mol |
| XLogP | 8.4 |
| Topological Polar Surface Area (TPSA) | 126.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 572.1262 Da |
| Heavy Atoms | 39 |
| Complexity | 1030.0 |
| SMILES | CCC(=CC1=[N+](C2=C(S1)C=CC3=CC=CC=C32)C)C=C4N(C5=C(S4)C=CC6=CC=CC=C65)CCCS(=O)(=O)[O-] |
| InChIKey | DGXYFVIOIQPORQ-UHFFFAOYSA-N |
Chemical Property Profile of EINECS 246-410-5
Property Insights of EINECS 246-410-5
The XLogP value of 8.4 indicates that EINECS 246-410-5 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for EINECS 246-410-5. Following Lipinski's Rule of Five, EINECS 246-410-5 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of EINECS 246-410-5?
The CAS number of EINECS 246-410-5 is 24687-33-0.
What is the molecular formula of EINECS 246-410-5?
The molecular formula of EINECS 246-410-5 is C31H28N2O3S3.
What is the molecular weight of EINECS 246-410-5?
The molecular weight of EINECS 246-410-5 is 572.1262 g/mol.
Where can I buy EINECS 246-410-5?
You can request a quote for EINECS 246-410-5 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for EINECS 246-410-5?
Yes, CoreyChem provides custom synthesis services for EINECS 246-410-5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.