AE-848/11242086
TL;DR: AE-848/11242086 (CAS 327082-99-5) is a chemical compound with molecular formula C20H17BrN4S and molecular weight 424.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-1,3-benzothiazol-2-amine
Also Known As: AE-848/11242086, (E)-2-(2-((1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)hydrazinyl)benzo[d]thiazole, 1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrole-3-carbaldehyde 1,3-benzothiazol-2-ylhydrazone, (2Z)-2-[(2E)-{[1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}hydrazinylidene]-2,3-dihydro-1,3-benzothiazole, N-[(E)-[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-1,3-benzothiazol-2-amine
| Molecular Formula | C20H17BrN4S |
|---|---|
| Molecular Weight | 424.04 g/mol |
| LogP | 5.91234 |
| Topological Polar Surface Area | 42.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 424.03574 |
| Heavy Atoms | 26 |
| Complexity | 1059.9073 |
Chemical Identifiers
| CAS Number | 327082-99-5 |
|---|---|
| SMILES | CC1=CC(=C(N1C2=CC=C(C=C2)Br)C)/C=N/NC3=NC4=CC=CC=C4S3 |
Product Overview
AE-848/11242086 (CAS 327082-99-5), with molecular formula C20H17BrN4S and molecular weight 424.04 g/mol. IUPAC: N-[(E)-[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-1,3-benzothiazol-2-amine.
Chemical Property Profile of AE-848/11242086
Property Insights of AE-848/11242086
The XLogP value of 5.91234 indicates that AE-848/11242086 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.21 Ų, AE-848/11242086 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AE-848/11242086 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 AE-848/11242086?
The CAS number of AE-848/11242086 is 327082-99-5.
What is the molecular formula of AE-848/11242086?
The molecular formula of AE-848/11242086 is C20H17BrN4S.
What is the molecular weight of AE-848/11242086?
The molecular weight of AE-848/11242086 is 424.04 g/mol.
Where can I buy AE-848/11242086?
You can request a quote for AE-848/11242086 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/11242086?
Yes, KEHONG BIO provides custom synthesis services for AE-848/11242086 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.