(NE)-4-chloro-N-[(6Z)-6-(3-methyl-1,3-benzothiazol-2-ylidene
TL;DR: (NE)-4-chloro-N-[(6Z)-6-(3-methyl-1,3-benzothiazol-2-ylidene (CAS 17234-85-4) is a chemical compound with molecular formula C20H15ClN2O2S2 and molecular weight 414.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa-2,4-dien-1-ylidene]benzenesulfonamide
Also Known As: (NE)-4-chloro-N-[(6Z)-6-(3-methyl-1,3-benzothiazol-2-ylidene, 4-chloro-N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa-2,4-dien-1-ylidene]benzenesulfonamide
| Molecular Formula | C20H15ClN2O2S2 |
|---|---|
| Molecular Weight | 414.03 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 83.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 414.02634 |
| Heavy Atoms | 27 |
| Complexity | 802.0 |
Chemical Identifiers
| CAS Number | 17234-85-4 |
|---|---|
| SMILES | CN1C2=CC=CC=C2SC1=C3C=CC=CC3=NS(=O)(=O)C4=CC=C(C=C4)Cl |
| InChIKey | RQJKMMINFJAOLQ-UHFFFAOYSA-N |
Product Overview
(NE)-4-chloro-N-[(6Z)-6-(3-methyl-1,3-benzothiazol-2-ylidene (CAS 17234-85-4), with molecular formula C20H15ClN2O2S2 and molecular weight 414.03 g/mol. IUPAC: 4-chloro-N-[6-(3-methyl-1,3-benzothiazol-2-ylidene)cyclohexa-2,4-dien-1-ylidene]benzenesulfonamide.
Chemical Property Profile of (NE)-4-chloro-N-[(6Z)-6-(3-methyl-1,3-benzothiazol-2-ylidene
Property Insights of (NE)-4-chloro-N-[(6Z)-6-(3-methyl-1,3-benzothiazol-2-ylidene
The XLogP value of 5.4 indicates that (NE)-4-chloro-N-[(6Z)-6-(3-methyl-1,3-benzothiazol-2-ylidene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (NE)-4-chloro-N-[(6Z)-6-(3-methyl-1,3-benzothiazol-2-ylidene. Following Lipinski's Rule of Five, (NE)-4-chloro-N-[(6Z)-6-(3-methyl-1,3-benzothiazol-2-ylidene 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 (NE)-4-chloro-N-[(6Z)-6-(3-methyl-1,3-benzothiazol-2-ylidene?
The CAS number of (NE)-4-chloro-N-[(6Z)-6-(3-methyl-1,3-benzothiazol-2-ylidene is 17234-85-4.
What is the molecular formula of (NE)-4-chloro-N-[(6Z)-6-(3-methyl-1,3-benzothiazol-2-ylidene?
The molecular formula of (NE)-4-chloro-N-[(6Z)-6-(3-methyl-1,3-benzothiazol-2-ylidene is C20H15ClN2O2S2.
What is the molecular weight of (NE)-4-chloro-N-[(6Z)-6-(3-methyl-1,3-benzothiazol-2-ylidene?
The molecular weight of (NE)-4-chloro-N-[(6Z)-6-(3-methyl-1,3-benzothiazol-2-ylidene is 414.03 g/mol.
Where can I buy (NE)-4-chloro-N-[(6Z)-6-(3-methyl-1,3-benzothiazol-2-ylidene?
You can request a quote for (NE)-4-chloro-N-[(6Z)-6-(3-methyl-1,3-benzothiazol-2-ylidene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (NE)-4-chloro-N-[(6Z)-6-(3-methyl-1,3-benzothiazol-2-ylidene?
Yes, KEHONG BIO provides custom synthesis services for (NE)-4-chloro-N-[(6Z)-6-(3-methyl-1,3-benzothiazol-2-ylidene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.