Bionet1_004853
TL;DR: Bionet1_004853 (CAS 477872-48-3) is a chemical compound with molecular formula C20H18ClN3O2S and molecular weight 399.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-[2-(4-chlorophenyl)-4-methyl-1,3-thiazol-5-yl]ethylideneamino] N-(4-methylphenyl)carbamate
Also Known As: Bionet1_004853, 2-(4-chlorophenyl)-4-methyl-5-{[(4-toluidinocarbonyl)oxy]ethanimidoyl}-1,3-thiazole, [1-[2-(4-chlorophenyl)-4-methyl-1,3-thiazol-5-yl]ethylideneamino] N-(4-methylphenyl)carbamate, {1-[2-(4-chlorophenyl)-4-methyl-1,3-thiazol-5-yl]ethylidene}amino N-(4-methylphenyl)carbamate
| Molecular Formula | C20H18ClN3O2S |
|---|---|
| Molecular Weight | 399.08 g/mol |
| LogP | 6.05304 |
| Topological Polar Surface Area | 63.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 399.0808 |
| Heavy Atoms | 27 |
| Complexity | 979.4664 |
Chemical Identifiers
| CAS Number | 477872-48-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)ON=C(C)C2=C(N=C(S2)C3=CC=C(C=C3)Cl)C |
Product Overview
Bionet1_004853 (CAS 477872-48-3), with molecular formula C20H18ClN3O2S and molecular weight 399.08 g/mol. IUPAC: [1-[2-(4-chlorophenyl)-4-methyl-1,3-thiazol-5-yl]ethylideneamino] N-(4-methylphenyl)carbamate.
Chemical Property Profile of Bionet1_004853
Property Insights of Bionet1_004853
The XLogP value of 6.05304 indicates that Bionet1_004853 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.58 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_004853. Following Lipinski's Rule of Five, Bionet1_004853 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bionet1_004853?
The CAS number of Bionet1_004853 is 477872-48-3.
What is the molecular formula of Bionet1_004853?
The molecular formula of Bionet1_004853 is C20H18ClN3O2S.
What is the molecular weight of Bionet1_004853?
The molecular weight of Bionet1_004853 is 399.08 g/mol.
Where can I buy Bionet1_004853?
You can request a quote for Bionet1_004853 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_004853?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_004853 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.