N-(3-chlorophenyl)-5,6-dimethoxy-1,3-benzothiazol-2-amine
TL;DR: N-(3-chlorophenyl)-5,6-dimethoxy-1,3-benzothiazol-2-amine (CAS 890958-13-1) is a chemical compound with molecular formula C15H13ClN2O2S and molecular weight 320.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chlorophenyl)-5,6-dimethoxy-1,3-benzothiazol-2-amine
Also Known As: N-(3-chlorophenyl)-5,6-dimethoxy-1,3-benzothiazol-2-amine, N-(3-chlorophenyl)-5,6-dimethoxybenzo[d]thiazol-2-amine, AB00677757-01, F2020-0434
| Molecular Formula | C15H13ClN2O2S |
|---|---|
| Molecular Weight | 320.04 g/mol |
| LogP | 4.7105 |
| Topological Polar Surface Area | 43.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 320.03864 |
| Heavy Atoms | 21 |
| Complexity | 747.4397 |
Chemical Identifiers
| CAS Number | 890958-13-1 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)N=C(S2)NC3=CC(=CC=C3)Cl)OC |
Product Overview
N-(3-chlorophenyl)-5,6-dimethoxy-1,3-benzothiazol-2-amine (CAS 890958-13-1), with molecular formula C15H13ClN2O2S and molecular weight 320.04 g/mol. IUPAC: N-(3-chlorophenyl)-5,6-dimethoxy-1,3-benzothiazol-2-amine.
Chemical Property Profile of N-(3-chlorophenyl)-5,6-dimethoxy-1,3-benzothiazol-2-amine
Property Insights of N-(3-chlorophenyl)-5,6-dimethoxy-1,3-benzothiazol-2-amine
The XLogP value of 4.7105 indicates that N-(3-chlorophenyl)-5,6-dimethoxy-1,3-benzothiazol-2-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.38 Ų, N-(3-chlorophenyl)-5,6-dimethoxy-1,3-benzothiazol-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-chlorophenyl)-5,6-dimethoxy-1,3-benzothiazol-2-amine has 1 hydrogen bond donor(s) and 5 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-chlorophenyl)-5,6-dimethoxy-1,3-benzothiazol-2-amine?
The CAS number of N-(3-chlorophenyl)-5,6-dimethoxy-1,3-benzothiazol-2-amine is 890958-13-1.
What is the molecular formula of N-(3-chlorophenyl)-5,6-dimethoxy-1,3-benzothiazol-2-amine?
The molecular formula of N-(3-chlorophenyl)-5,6-dimethoxy-1,3-benzothiazol-2-amine is C15H13ClN2O2S.
What is the molecular weight of N-(3-chlorophenyl)-5,6-dimethoxy-1,3-benzothiazol-2-amine?
The molecular weight of N-(3-chlorophenyl)-5,6-dimethoxy-1,3-benzothiazol-2-amine is 320.04 g/mol.
Where can I buy N-(3-chlorophenyl)-5,6-dimethoxy-1,3-benzothiazol-2-amine?
You can request a quote for N-(3-chlorophenyl)-5,6-dimethoxy-1,3-benzothiazol-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-chlorophenyl)-5,6-dimethoxy-1,3-benzothiazol-2-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(3-chlorophenyl)-5,6-dimethoxy-1,3-benzothiazol-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.