BAS 00386067
TL;DR: BAS 00386067 (CAS 331665-58-8) is a chemical compound with molecular formula C20H14Br2N2O3 and molecular weight 487.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-3-anilino-1-(4-bromophenyl)-3-oxoprop-1-en-2-yl]-5-bromofuran-2-carboxamide
Also Known As: BAS 00386067, (2E)-2-[(5-bromo(2-furyl))carbonylamino]-3-(4-bromophenyl)-N-phenylprop-2-enam ide, (E)-5-bromo-N-(1-(4-bromophenyl)-3-oxo-3-(phenylamino)prop-1-en-2-yl)furan-2-carboxamide, N-[(E)-3-anilino-1-(4-bromophenyl)-3-oxoprop-1-en-2-yl]-5-bromofuran-2-carboxamide, 5-bromo-N-[(1E)-1-(4-bromophenyl)-3-oxo-3-(phenylamino)prop-1-en-2-yl]furan-2-carboxamide
| Molecular Formula | C20H14Br2N2O3 |
|---|---|
| Molecular Weight | 487.94 g/mol |
| LogP | 5.2142 |
| Topological Polar Surface Area | 71.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 487.93713 |
| Heavy Atoms | 27 |
| Complexity | 979.97614 |
Chemical Identifiers
| CAS Number | 331665-58-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)/C(=C\C2=CC=C(C=C2)Br)/NC(=O)C3=CC=C(O3)Br |
Product Overview
BAS 00386067 (CAS 331665-58-8), with molecular formula C20H14Br2N2O3 and molecular weight 487.94 g/mol. IUPAC: N-[(E)-3-anilino-1-(4-bromophenyl)-3-oxoprop-1-en-2-yl]-5-bromofuran-2-carboxamide.
Chemical Property Profile of BAS 00386067
Property Insights of BAS 00386067
The XLogP value of 5.2142 indicates that BAS 00386067 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.34 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00386067. Following Lipinski's Rule of Five, BAS 00386067 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00386067?
The CAS number of BAS 00386067 is 331665-58-8.
What is the molecular formula of BAS 00386067?
The molecular formula of BAS 00386067 is C20H14Br2N2O3.
What is the molecular weight of BAS 00386067?
The molecular weight of BAS 00386067 is 487.94 g/mol.
Where can I buy BAS 00386067?
You can request a quote for BAS 00386067 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00386067?
Yes, KEHONG BIO provides custom synthesis services for BAS 00386067 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.