1-(3-chlorophenyl)-N-(5-methyl-1,2-benzothiazol-3-yl)methanimine
TL;DR: 1-(3-chlorophenyl)-N-(5-methyl-1,2-benzothiazol-3-yl)methanimine (CAS 647026-40-2) is a chemical compound with molecular formula C15H11ClN2S and molecular weight 286.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-chlorophenyl)-N-(5-methyl-1,2-benzothiazol-3-yl)methanimine
Also Known As: 1-(3-chlorophenyl)-N-(5-methyl-1,2-benzothiazol-3-yl)methanimine, 1H-Pyrrole-3,4-dicarboxylic acid,dibutyl ester, 1,2-Benzisothiazol-3-amine, N-[(3-chlorophenyl)methylene]-5-methyl-, (3-Chloro-benzylidene)-(5-methyl-benzo[d]isothiazol-3-yl)-amine, (E)-1-(3-Chlorophenyl)-N-(5-methyl-1,2-benzothiazol-3-yl)methanimine
| Molecular Formula | C15H11ClN2S |
|---|---|
| Molecular Weight | 286.03 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 53.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 286.03314 |
| Heavy Atoms | 19 |
| Complexity | 336.0 |
Chemical Identifiers
| CAS Number | 647026-40-2 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)SN=C2N=CC3=CC(=CC=C3)Cl |
| InChIKey | AQGFOYOTRIBVAL-UHFFFAOYSA-N |
Product Overview
1-(3-chlorophenyl)-N-(5-methyl-1,2-benzothiazol-3-yl)methanimine (CAS 647026-40-2), with molecular formula C15H11ClN2S and molecular weight 286.03 g/mol. IUPAC: 1-(3-chlorophenyl)-N-(5-methyl-1,2-benzothiazol-3-yl)methanimine.
Chemical Property Profile of 1-(3-chlorophenyl)-N-(5-methyl-1,2-benzothiazol-3-yl)methanimine
Property Insights of 1-(3-chlorophenyl)-N-(5-methyl-1,2-benzothiazol-3-yl)methanimine
The XLogP value of 4.9 indicates that 1-(3-chlorophenyl)-N-(5-methyl-1,2-benzothiazol-3-yl)methanimine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.5 Ų, 1-(3-chlorophenyl)-N-(5-methyl-1,2-benzothiazol-3-yl)methanimine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-chlorophenyl)-N-(5-methyl-1,2-benzothiazol-3-yl)methanimine has 0 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 1-(3-chlorophenyl)-N-(5-methyl-1,2-benzothiazol-3-yl)methanimine?
The CAS number of 1-(3-chlorophenyl)-N-(5-methyl-1,2-benzothiazol-3-yl)methanimine is 647026-40-2.
What is the molecular formula of 1-(3-chlorophenyl)-N-(5-methyl-1,2-benzothiazol-3-yl)methanimine?
The molecular formula of 1-(3-chlorophenyl)-N-(5-methyl-1,2-benzothiazol-3-yl)methanimine is C15H11ClN2S.
What is the molecular weight of 1-(3-chlorophenyl)-N-(5-methyl-1,2-benzothiazol-3-yl)methanimine?
The molecular weight of 1-(3-chlorophenyl)-N-(5-methyl-1,2-benzothiazol-3-yl)methanimine is 286.03 g/mol.
Where can I buy 1-(3-chlorophenyl)-N-(5-methyl-1,2-benzothiazol-3-yl)methanimine?
You can request a quote for 1-(3-chlorophenyl)-N-(5-methyl-1,2-benzothiazol-3-yl)methanimine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-chlorophenyl)-N-(5-methyl-1,2-benzothiazol-3-yl)methanimine?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-chlorophenyl)-N-(5-methyl-1,2-benzothiazol-3-yl)methanimine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.