IFLab1_001911
TL;DR: IFLab1_001911 (CAS 392326-66-8) is a chemical compound with molecular formula C17H16ClN3OS and molecular weight 345.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-chloro-3-methyl-1,3-benzothiazol-2-ylidene)-4-(dimethylamino)benzamide
Also Known As: IFLab1_001911, (Z)-N-(6-chloro-3-methylbenzo[d]thiazol-2(3H)-ylidene)-4-(dimethylamino)benzamide, F0447-0344, N-(6-chloro-3-methyl-1,3-benzothiazol-2-ylidene)-4-(dimethylamino)benzamide, N-[(2Z)-6-chloro-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]-4-(dimethylamino)benzamide
| Molecular Formula | C17H16ClN3OS |
|---|---|
| Molecular Weight | 345.07 g/mol |
| LogP | 3.7003 |
| Topological Polar Surface Area | 37.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 345.07025 |
| Heavy Atoms | 23 |
| Complexity | 938.622 |
Chemical Identifiers
| CAS Number | 392326-66-8 |
|---|---|
| SMILES | CN1C2=C(C=C(C=C2)Cl)SC1=NC(=O)C3=CC=C(C=C3)N(C)C |
Product Overview
IFLab1_001911 (CAS 392326-66-8), with molecular formula C17H16ClN3OS and molecular weight 345.07 g/mol. IUPAC: N-(6-chloro-3-methyl-1,3-benzothiazol-2-ylidene)-4-(dimethylamino)benzamide.
Chemical Property Profile of IFLab1_001911
Property Insights of IFLab1_001911
The XLogP value of 3.7003 indicates that IFLab1_001911 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.6 Ų, IFLab1_001911 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, IFLab1_001911 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 IFLab1_001911?
The CAS number of IFLab1_001911 is 392326-66-8.
What is the molecular formula of IFLab1_001911?
The molecular formula of IFLab1_001911 is C17H16ClN3OS.
What is the molecular weight of IFLab1_001911?
The molecular weight of IFLab1_001911 is 345.07 g/mol.
Where can I buy IFLab1_001911?
You can request a quote for IFLab1_001911 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for IFLab1_001911?
Yes, KEHONG BIO provides custom synthesis services for IFLab1_001911 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.