N-(3-chloro-2-methylphenyl)-1,2-benzothiazol-3-amine 1,1-dioxide
TL;DR: N-(3-chloro-2-methylphenyl)-1,2-benzothiazol-3-amine 1,1-dioxide (CAS 311322-82-4) is a chemical compound with molecular formula C14H11ClN2O2S and molecular weight 306.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-2-methylphenyl)-1,1-dioxo-1,2-benzothiazol-3-amine
Also Known As: TimTec1_005608, N-(3-chloro-2-methylphenyl)-1,1-dioxo-1,2-benzothiazol-3-amine, N-(3-chloro-2-methylphenyl)-1,2-benzothiazol-3-amine 1,1-dioxide, 3-((3-Chloro-2-methylphenyl)amino)benzo[d]isothiazole 1,1-dioxide, 3-[(3-chloro-2-methylphenyl)amino]-1lambda,2-benzothiazole-1,1-dione
| Molecular Formula | C14H11ClN2O2S |
|---|---|
| Molecular Weight | 306.02 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 66.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 306.02298 |
| Heavy Atoms | 20 |
| Complexity | 500.0 |
Chemical Identifiers
| CAS Number | 311322-82-4 |
|---|---|
| SMILES | CC1=C(C=CC=C1Cl)NC2=NS(=O)(=O)C3=CC=CC=C32 |
| InChIKey | RUAXNIYXSBBWAN-UHFFFAOYSA-N |
Product Overview
N-(3-chloro-2-methylphenyl)-1,2-benzothiazol-3-amine 1,1-dioxide (CAS 311322-82-4), with molecular formula C14H11ClN2O2S and molecular weight 306.02 g/mol. IUPAC: N-(3-chloro-2-methylphenyl)-1,1-dioxo-1,2-benzothiazol-3-amine.
Chemical Property Profile of N-(3-chloro-2-methylphenyl)-1,2-benzothiazol-3-amine 1,1-dioxide
Property Insights of N-(3-chloro-2-methylphenyl)-1,2-benzothiazol-3-amine 1,1-dioxide
The XLogP value of 3.0 indicates that N-(3-chloro-2-methylphenyl)-1,2-benzothiazol-3-amine 1,1-dioxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-chloro-2-methylphenyl)-1,2-benzothiazol-3-amine 1,1-dioxide. Following Lipinski's Rule of Five, N-(3-chloro-2-methylphenyl)-1,2-benzothiazol-3-amine 1,1-dioxide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(3-chloro-2-methylphenyl)-1,2-benzothiazol-3-amine 1,1-dioxide?
The CAS number of N-(3-chloro-2-methylphenyl)-1,2-benzothiazol-3-amine 1,1-dioxide is 311322-82-4.
What is the molecular formula of N-(3-chloro-2-methylphenyl)-1,2-benzothiazol-3-amine 1,1-dioxide?
The molecular formula of N-(3-chloro-2-methylphenyl)-1,2-benzothiazol-3-amine 1,1-dioxide is C14H11ClN2O2S.
What is the molecular weight of N-(3-chloro-2-methylphenyl)-1,2-benzothiazol-3-amine 1,1-dioxide?
The molecular weight of N-(3-chloro-2-methylphenyl)-1,2-benzothiazol-3-amine 1,1-dioxide is 306.02 g/mol.
Where can I buy N-(3-chloro-2-methylphenyl)-1,2-benzothiazol-3-amine 1,1-dioxide?
You can request a quote for N-(3-chloro-2-methylphenyl)-1,2-benzothiazol-3-amine 1,1-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-chloro-2-methylphenyl)-1,2-benzothiazol-3-amine 1,1-dioxide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-chloro-2-methylphenyl)-1,2-benzothiazol-3-amine 1,1-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.