6-Chloro-1,3-benzodioxole-5-carboxaldehyde 2-(2-benzothiazolyl)hydrazone
TL;DR: 6-Chloro-1,3-benzodioxole-5-carboxaldehyde 2-(2-benzothiazolyl)hydrazone (CAS 359899-82-4) is a chemical compound with molecular formula C15H10ClN3O2S and molecular weight 331.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(6-chloro-1,3-benzodioxol-5-yl)methylideneamino]-1,3-benzothiazol-2-amine
Also Known As: 6-Chloro-1,3-benzodioxole-5-carboxaldehyde 2-(2-benzothiazolyl)hydrazone, N-[(6-chlorobenzo[1,3]dioxol-5-yl)methylideneamino]benzothiazol-2-amine, 2-{2-[(6-Chloro-2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-1,3-benzothiazole, N-[(6-chloro-1,3-benzodioxol-5-yl)methylideneamino]-1,3-benzothiazol-2-amine
| Molecular Formula | C15H10ClN3O2S |
|---|---|
| Molecular Weight | 331.02 g/mol |
| LogP | 4.1244 |
| Topological Polar Surface Area | 55.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 331.01822 |
| Heavy Atoms | 22 |
| Complexity | 845.3501 |
Chemical Identifiers
| CAS Number | 359899-82-4 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C(=C2)C=NNC3=NC4=CC=CC=C4S3)Cl |
Product Overview
6-Chloro-1,3-benzodioxole-5-carboxaldehyde 2-(2-benzothiazolyl)hydrazone (CAS 359899-82-4), with molecular formula C15H10ClN3O2S and molecular weight 331.02 g/mol. IUPAC: N-[(6-chloro-1,3-benzodioxol-5-yl)methylideneamino]-1,3-benzothiazol-2-amine.
Chemical Property Profile of 6-Chloro-1,3-benzodioxole-5-carboxaldehyde 2-(2-benzothiazolyl)hydrazone
Property Insights of 6-Chloro-1,3-benzodioxole-5-carboxaldehyde 2-(2-benzothiazolyl)hydrazone
The XLogP value of 4.1244 indicates that 6-Chloro-1,3-benzodioxole-5-carboxaldehyde 2-(2-benzothiazolyl)hydrazone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.74 Ų, 6-Chloro-1,3-benzodioxole-5-carboxaldehyde 2-(2-benzothiazolyl)hydrazone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Chloro-1,3-benzodioxole-5-carboxaldehyde 2-(2-benzothiazolyl)hydrazone has 1 hydrogen bond donor(s) and 6 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 6-Chloro-1,3-benzodioxole-5-carboxaldehyde 2-(2-benzothiazolyl)hydrazone?
The CAS number of 6-Chloro-1,3-benzodioxole-5-carboxaldehyde 2-(2-benzothiazolyl)hydrazone is 359899-82-4.
What is the molecular formula of 6-Chloro-1,3-benzodioxole-5-carboxaldehyde 2-(2-benzothiazolyl)hydrazone?
The molecular formula of 6-Chloro-1,3-benzodioxole-5-carboxaldehyde 2-(2-benzothiazolyl)hydrazone is C15H10ClN3O2S.
What is the molecular weight of 6-Chloro-1,3-benzodioxole-5-carboxaldehyde 2-(2-benzothiazolyl)hydrazone?
The molecular weight of 6-Chloro-1,3-benzodioxole-5-carboxaldehyde 2-(2-benzothiazolyl)hydrazone is 331.02 g/mol.
Where can I buy 6-Chloro-1,3-benzodioxole-5-carboxaldehyde 2-(2-benzothiazolyl)hydrazone?
You can request a quote for 6-Chloro-1,3-benzodioxole-5-carboxaldehyde 2-(2-benzothiazolyl)hydrazone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Chloro-1,3-benzodioxole-5-carboxaldehyde 2-(2-benzothiazolyl)hydrazone?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro-1,3-benzodioxole-5-carboxaldehyde 2-(2-benzothiazolyl)hydrazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.