BRD-K37139387-001-01-9
TL;DR: BRD-K37139387-001-01-9 (CAS 895803-06-2) is a chemical compound with molecular formula C22H22FN3O2S and molecular weight 411.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-(2-ethylphenyl)-N-[2-[2-(4-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]ethyl]oxamide
Also Known As: BRD-K37139387-001-01-9, N'-(2-ethylphenyl)-N-{2-[2-(4-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]ethyl}ethanediamide, F2053-0335, N'-(2-ethylphenyl)-N-[2-[2-(4-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]ethyl]oxamide, N1-(2-ethylphenyl)-N2-(2-(2-(4-fluorophenyl)-4-methylthiazol-5-yl)ethyl)oxalamide
| Molecular Formula | C22H22FN3O2S |
|---|---|
| Molecular Weight | 411.14 g/mol |
| LogP | 4.11742 |
| Topological Polar Surface Area | 71.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 411.14166 |
| Heavy Atoms | 29 |
| Complexity | 1015.1518 |
Chemical Identifiers
| CAS Number | 895803-06-2 |
|---|---|
| SMILES | CCC1=CC=CC=C1NC(=O)C(=O)NCCC2=C(N=C(S2)C3=CC=C(C=C3)F)C |
Product Overview
BRD-K37139387-001-01-9 (CAS 895803-06-2), with molecular formula C22H22FN3O2S and molecular weight 411.14 g/mol. IUPAC: N'-(2-ethylphenyl)-N-[2-[2-(4-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]ethyl]oxamide.
Chemical Property Profile of BRD-K37139387-001-01-9
Property Insights of BRD-K37139387-001-01-9
The XLogP value of 4.11742 indicates that BRD-K37139387-001-01-9 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.09 Ų falls within the moderate polarity range, balancing permeability and solubility for BRD-K37139387-001-01-9. Following Lipinski's Rule of Five, BRD-K37139387-001-01-9 has 2 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 BRD-K37139387-001-01-9?
The CAS number of BRD-K37139387-001-01-9 is 895803-06-2.
What is the molecular formula of BRD-K37139387-001-01-9?
The molecular formula of BRD-K37139387-001-01-9 is C22H22FN3O2S.
What is the molecular weight of BRD-K37139387-001-01-9?
The molecular weight of BRD-K37139387-001-01-9 is 411.14 g/mol.
Where can I buy BRD-K37139387-001-01-9?
You can request a quote for BRD-K37139387-001-01-9 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BRD-K37139387-001-01-9?
Yes, KEHONG BIO provides custom synthesis services for BRD-K37139387-001-01-9 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.