BAS 02070127
TL;DR: BAS 02070127 (CAS 445229-36-7) is a chemical compound with molecular formula C25H24BrN5O2S and molecular weight 537.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-bromophenyl)-2-[[5-[(4-ethoxyanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: BAS 02070127, N-(2-Bromophenyl)-2-((5-(((4-ethoxyphenyl)amino)methyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)acetamide, N-(2-bromophenyl)-2-[[5-[(4-ethoxyanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide, N-(2-Bromo-phenyl)-2-{5-[(4-ethoxy-phenylamino)-methyl]-4-phenyl-4H-[1,2,4]triazol-3-ylsulfanyl}-acetamide, N-(2-bromophenyl)-2-({5-[(4-ethoxyanilino)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
| Molecular Formula | C25H24BrN5O2S |
|---|---|
| Molecular Weight | 537.08 g/mol |
| LogP | 5.7714 |
| Topological Polar Surface Area | 81.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 537.08344 |
| Heavy Atoms | 34 |
| Complexity | 1231.8068 |
Chemical Identifiers
| CAS Number | 445229-36-7 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NCC2=NN=C(N2C3=CC=CC=C3)SCC(=O)NC4=CC=CC=C4Br |
Product Overview
BAS 02070127 (CAS 445229-36-7), with molecular formula C25H24BrN5O2S and molecular weight 537.08 g/mol. IUPAC: N-(2-bromophenyl)-2-[[5-[(4-ethoxyanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of BAS 02070127
Property Insights of BAS 02070127
The XLogP value of 5.7714 indicates that BAS 02070127 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.07 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02070127. Following Lipinski's Rule of Five, BAS 02070127 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 02070127?
The CAS number of BAS 02070127 is 445229-36-7.
What is the molecular formula of BAS 02070127?
The molecular formula of BAS 02070127 is C25H24BrN5O2S.
What is the molecular weight of BAS 02070127?
The molecular weight of BAS 02070127 is 537.08 g/mol.
Where can I buy BAS 02070127?
You can request a quote for BAS 02070127 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02070127?
Yes, KEHONG BIO provides custom synthesis services for BAS 02070127 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.