EINECS 266-996-6
TL;DR: EINECS 266-996-6 (CAS 67748-63-4) is a chemical compound with molecular formula C30H28N2O4S2 and molecular weight 544.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-2-(1-ethylbenzo[e][1,3]benzothiazol-1-ium-2-yl)ethenyl]-N-phenylacetamide;4-methylbenzenesulfonate
Also Known As: EINECS 266-996-6, Naphtho[1,2-d]thiazolium, 2-[2-(acetylphenylamino)ethenyl]-1-ethyl-, salt with 4-methylbenzenesulfonic acid (1:1), 1-Ethyl-2-(2-(2-(phenylacetylamino))ethenyl)naphtho(1,2-d)thiazolium, 4-methylbenzenesulfonate, 3-Ethyl-2-(2-(N-(phenyl)acetylamino)ethenyl)naphtho(1,2-d)thiazolium,4-methylbenzenesulfonate, Naphtho(1,2-d)thiazolium, 2-(2-(acetylphenylamino)ethenyl)-1-ethyl-, 4-methylbenzenesulfonate (1:1)
| Molecular Formula | C30H28N2O4S2 |
|---|---|
| Molecular Weight | 544.15 g/mol |
| LogP | 6.28482 |
| Topological Polar Surface Area | 81.39 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 544.14905 |
| Heavy Atoms | 38 |
| Complexity | 1708.639 |
Chemical Identifiers
| CAS Number | 67748-63-4 |
|---|---|
| SMILES | CC[N+]1=C(SC2=C1C3=CC=CC=C3C=C2)/C=C/N(C4=CC=CC=C4)C(=O)C.CC1=CC=C(C=C1)S(=O)(=O)[O-] |
Product Overview
EINECS 266-996-6 (CAS 67748-63-4), with molecular formula C30H28N2O4S2 and molecular weight 544.15 g/mol. IUPAC: N-[(E)-2-(1-ethylbenzo[e][1,3]benzothiazol-1-ium-2-yl)ethenyl]-N-phenylacetamide;4-methylbenzenesulfonate.
Chemical Property Profile of EINECS 266-996-6
Property Insights of EINECS 266-996-6
The XLogP value of 6.28482 indicates that EINECS 266-996-6 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.39 Ų falls within the moderate polarity range, balancing permeability and solubility for EINECS 266-996-6. Following Lipinski's Rule of Five, EINECS 266-996-6 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of EINECS 266-996-6?
The CAS number of EINECS 266-996-6 is 67748-63-4.
What is the molecular formula of EINECS 266-996-6?
The molecular formula of EINECS 266-996-6 is C30H28N2O4S2.
What is the molecular weight of EINECS 266-996-6?
The molecular weight of EINECS 266-996-6 is 544.15 g/mol.
Where can I buy EINECS 266-996-6?
You can request a quote for EINECS 266-996-6 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 266-996-6?
Yes, KEHONG BIO provides custom synthesis services for EINECS 266-996-6 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.