![N-[[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzothiazol-2-amine structure](/static/products/676/676154-58-8.png)
N-[[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzothiazol-2-amine
TL;DR: N-[[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzothiazol-2-amine (CAS 676154-58-8) is a chemical compound with molecular formula C22H22N4S and molecular weight 374.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-[1-(2,6-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-1,3-benzothiazol-2-amine
Also Known As: N-[[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzothiazol-2-amine, (2Z)-2-[(2E)-{[1-(2,6-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}hydrazinylidene]-2,3-dihydro-1,3-benzothiazole, (E)-2-(2-((1-(2,6-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)hydrazinyl)benzo[d]thiazole, {(1E)-2-[1-(2,6-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]-1-azavinyl}benzothiaz ol-2-ylamine, 2-[(2E)-2-{[1-(2,6-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}hydrazinyl]-1,3-benzothiazole
| Molecular Formula | C22H22N4S |
|---|---|
| Molecular Weight | 374.16 g/mol |
| LogP | 5.76668 |
| Topological Polar Surface Area | 42.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 374.15652 |
| Heavy Atoms | 27 |
| Complexity | 1097.2969 |
Chemical Identifiers
| CAS Number | 676154-58-8 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)N2C(=CC(=C2C)/C=N/NC3=NC4=CC=CC=C4S3)C |
Product Overview
N-[[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzothiazol-2-amine (CAS 676154-58-8), with molecular formula C22H22N4S and molecular weight 374.16 g/mol. IUPAC: N-[(E)-[1-(2,6-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-1,3-benzothiazol-2-amine.
Chemical Property Profile of N-[[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzothiazol-2-amine
Property Insights of N-[[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzothiazol-2-amine
The XLogP value of 5.76668 indicates that N-[[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzothiazol-2-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.21 Ų, N-[[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzothiazol-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzothiazol-2-amine has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzothiazol-2-amine?
The CAS number of N-[[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzothiazol-2-amine is 676154-58-8.
What is the molecular formula of N-[[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzothiazol-2-amine?
The molecular formula of N-[[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzothiazol-2-amine is C22H22N4S.
What is the molecular weight of N-[[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzothiazol-2-amine?
The molecular weight of N-[[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzothiazol-2-amine is 374.16 g/mol.
Where can I buy N-[[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzothiazol-2-amine?
You can request a quote for N-[[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]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-[[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzothiazol-2-amine?
Yes, KEHONG BIO provides custom synthesis services for N-[[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzothiazol-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.