BAS 00776351
TL;DR: BAS 00776351 (CAS 1164466-39-0) is a chemical compound with molecular formula C20H18N2O3S and molecular weight 366.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-3-(furan-2-ylmethylamino)-3-oxo-1-thiophen-2-ylprop-1-en-2-yl]-4-methylbenzamide
Also Known As: BAS 00776351, N-(3-((Furan-2-ylmethyl)amino)-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl)-4-methylbenzamide, N-{1-[(Furan-2-ylmethyl)-carbamoyl]-2-thiophen-2-yl-vinyl}-4-methyl-benzamide, N-[(E)-3-(furan-2-ylmethylamino)-3-oxo-1-thiophen-2-ylprop-1-en-2-yl]-4-methylbenzamide, N-[1-{[(2-furylmethyl)amino]carbonyl}-2-(2-thienyl)vinyl]-4-methylbenzamide
| Molecular Formula | C20H18N2O3S |
|---|---|
| Molecular Weight | 366.10 g/mol |
| LogP | 3.73682 |
| Topological Polar Surface Area | 71.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 366.10382 |
| Heavy Atoms | 26 |
| Complexity | 895.2065 |
Chemical Identifiers
| CAS Number | 1164466-39-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)N/C(=C/C2=CC=CS2)/C(=O)NCC3=CC=CO3 |
Product Overview
BAS 00776351 (CAS 1164466-39-0), with molecular formula C20H18N2O3S and molecular weight 366.10 g/mol. IUPAC: N-[(E)-3-(furan-2-ylmethylamino)-3-oxo-1-thiophen-2-ylprop-1-en-2-yl]-4-methylbenzamide.
Chemical Property Profile of BAS 00776351
Property Insights of BAS 00776351
The XLogP value of 3.73682 indicates that BAS 00776351 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 00776351. Following Lipinski's Rule of Five, BAS 00776351 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 BAS 00776351?
The CAS number of BAS 00776351 is 1164466-39-0.
What is the molecular formula of BAS 00776351?
The molecular formula of BAS 00776351 is C20H18N2O3S.
What is the molecular weight of BAS 00776351?
The molecular weight of BAS 00776351 is 366.10 g/mol.
Where can I buy BAS 00776351?
You can request a quote for BAS 00776351 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00776351?
Yes, KEHONG BIO provides custom synthesis services for BAS 00776351 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.