BAS 02945753
TL;DR: BAS 02945753 (CAS 333747-41-4) is a chemical compound with molecular formula C16H21N3O2S and molecular weight 319.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-(3-methyl-4-propan-2-ylphenoxy)acetamide
Also Known As: BAS 02945753, N-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]-2-[3-methyl-4-(propan-2-yl)phenoxy]acetamide, N-(5-ethyl(1,3,4-thiadiazol-2-yl))-2-[3-methyl-4-(methylethyl)phenoxy]acetamid e, N-(5-Ethyl-[1,3,4]thiadiazol-2-yl)-2-(4-isopropyl-3-methyl-phenoxy)-acetamide, N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-(3-methyl-4-propan-2-ylphenoxy)acetamide
| Molecular Formula | C16H21N3O2S |
|---|---|
| Molecular Weight | 319.14 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 92.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 319.13544 |
| Heavy Atoms | 22 |
| Complexity | 367.0 |
Chemical Identifiers
| CAS Number | 333747-41-4 |
|---|---|
| SMILES | CCC1=NN=C(S1)NC(=O)COC2=CC(=C(C=C2)C(C)C)C |
| InChIKey | GCEINWSEMCAZMA-UHFFFAOYSA-N |
Product Overview
BAS 02945753 (CAS 333747-41-4), with molecular formula C16H21N3O2S and molecular weight 319.14 g/mol. IUPAC: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-(3-methyl-4-propan-2-ylphenoxy)acetamide.
Chemical Property Profile of BAS 02945753
Property Insights of BAS 02945753
The XLogP value of 3.9 indicates that BAS 02945753 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.4 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02945753. Following Lipinski's Rule of Five, BAS 02945753 has 1 hydrogen bond donor(s) and 5 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 BAS 02945753?
The CAS number of BAS 02945753 is 333747-41-4.
What is the molecular formula of BAS 02945753?
The molecular formula of BAS 02945753 is C16H21N3O2S.
What is the molecular weight of BAS 02945753?
The molecular weight of BAS 02945753 is 319.14 g/mol.
Where can I buy BAS 02945753?
You can request a quote for BAS 02945753 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02945753?
Yes, KEHONG BIO provides custom synthesis services for BAS 02945753 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.