ChemDiv3_001807
TL;DR: ChemDiv3_001807 (CAS 441291-53-8) is a chemical compound with molecular formula C17H14Cl2N2O3S and molecular weight 396.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,4-dichlorophenoxy)-N-(4-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)acetamide
Also Known As: ChemDiv3_001807, IDI1_020773, F0834-1077, (E)-2-(2,4-dichlorophenoxy)-N-(4-methoxy-3-methylbenzo[d]thiazol-2(3H)-ylidene)acetamide, 2-(2,4-dichlorophenoxy)-N-[(2E)-4-methoxy-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]acetamide
| Molecular Formula | C17H14Cl2N2O3S |
|---|---|
| Molecular Weight | 396.01 g/mol |
| LogP | 4.0615 |
| Topological Polar Surface Area | 52.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 396.01022 |
| Heavy Atoms | 25 |
| Complexity | 1010.7859 |
Chemical Identifiers
| CAS Number | 441291-53-8 |
|---|---|
| SMILES | CN1C2=C(C=CC=C2SC1=NC(=O)COC3=C(C=C(C=C3)Cl)Cl)OC |
Product Overview
ChemDiv3_001807 (CAS 441291-53-8), with molecular formula C17H14Cl2N2O3S and molecular weight 396.01 g/mol. IUPAC: 2-(2,4-dichlorophenoxy)-N-(4-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)acetamide.
Chemical Property Profile of ChemDiv3_001807
Property Insights of ChemDiv3_001807
The XLogP value of 4.0615 indicates that ChemDiv3_001807 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.82 Ų, ChemDiv3_001807 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv3_001807 has 0 hydrogen bond donor(s) and 4 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 ChemDiv3_001807?
The CAS number of ChemDiv3_001807 is 441291-53-8.
What is the molecular formula of ChemDiv3_001807?
The molecular formula of ChemDiv3_001807 is C17H14Cl2N2O3S.
What is the molecular weight of ChemDiv3_001807?
The molecular weight of ChemDiv3_001807 is 396.01 g/mol.
Where can I buy ChemDiv3_001807?
You can request a quote for ChemDiv3_001807 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_001807?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_001807 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.