BRD-K44425214-001-01-2
TL;DR: BRD-K44425214-001-01-2 (CAS 894011-55-3) is a chemical compound with molecular formula C21H19N3O4S and molecular weight 409.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-(1,3-benzodioxol-5-yl)-N-[2-(4-methyl-2-phenyl-1,3-thiazol-5-yl)ethyl]oxamide
Also Known As: BRD-K44425214-001-01-2, G856-2942, N'-(2H-1,3-benzodioxol-5-yl)-N-[2-(4-methyl-2-phenyl-1,3-thiazol-5-yl)ethyl]ethanediamide, F2011-1205, N'-(1,3-benzodioxol-5-yl)-N-[2-(4-methyl-2-phenyl-1,3-thiazol-5-yl)ethyl]oxamide
| Molecular Formula | C21H19N3O4S |
|---|---|
| Molecular Weight | 409.11 g/mol |
| LogP | 3.14462 |
| Topological Polar Surface Area | 89.55 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 409.10962 |
| Heavy Atoms | 29 |
| Complexity | 1049.3347 |
Chemical Identifiers
| CAS Number | 894011-55-3 |
|---|---|
| SMILES | CC1=C(SC(=N1)C2=CC=CC=C2)CCNC(=O)C(=O)NC3=CC4=C(C=C3)OCO4 |
Product Overview
BRD-K44425214-001-01-2 (CAS 894011-55-3), with molecular formula C21H19N3O4S and molecular weight 409.11 g/mol. IUPAC: N'-(1,3-benzodioxol-5-yl)-N-[2-(4-methyl-2-phenyl-1,3-thiazol-5-yl)ethyl]oxamide.
Chemical Property Profile of BRD-K44425214-001-01-2
Property Insights of BRD-K44425214-001-01-2
The XLogP value of 3.14462 indicates that BRD-K44425214-001-01-2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.55 Ų falls within the moderate polarity range, balancing permeability and solubility for BRD-K44425214-001-01-2. Following Lipinski's Rule of Five, BRD-K44425214-001-01-2 has 2 hydrogen bond donor(s) and 6 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 BRD-K44425214-001-01-2?
The CAS number of BRD-K44425214-001-01-2 is 894011-55-3.
What is the molecular formula of BRD-K44425214-001-01-2?
The molecular formula of BRD-K44425214-001-01-2 is C21H19N3O4S.
What is the molecular weight of BRD-K44425214-001-01-2?
The molecular weight of BRD-K44425214-001-01-2 is 409.11 g/mol.
Where can I buy BRD-K44425214-001-01-2?
You can request a quote for BRD-K44425214-001-01-2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BRD-K44425214-001-01-2?
Yes, KEHONG BIO provides custom synthesis services for BRD-K44425214-001-01-2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.