BAS 01123358
TL;DR: BAS 01123358 (CAS 332106-86-2) is a chemical compound with molecular formula C21H17N3O5 and molecular weight 391.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-3-(benzylamino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]furan-2-carboxamide
Also Known As: BAS 01123358, N-[1-[(benzylamino)carbonyl]-2-(4-nitrophenyl)vinyl]-2-furamide, (E)-N-(3-(benzylamino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl)furan-2-carboxamide, N-[(1E)-3-(benzylamino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]furan-2-carboxamide, N-[(E)-3-(benzylamino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]furan-2-carboxamide
| Molecular Formula | C21H17N3O5 |
|---|---|
| Molecular Weight | 391.12 g/mol |
| LogP | 3.2751 |
| Topological Polar Surface Area | 114.48 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 391.11682 |
| Heavy Atoms | 29 |
| Complexity | 1025.9481 |
Chemical Identifiers
| CAS Number | 332106-86-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC(=O)/C(=C\C2=CC=C(C=C2)[N+](=O)[O-])/NC(=O)C3=CC=CO3 |
Product Overview
BAS 01123358 (CAS 332106-86-2), with molecular formula C21H17N3O5 and molecular weight 391.12 g/mol. IUPAC: N-[(E)-3-(benzylamino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]furan-2-carboxamide.
Chemical Property Profile of BAS 01123358
Property Insights of BAS 01123358
The XLogP value of 3.2751 indicates that BAS 01123358 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.48 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01123358. Following Lipinski's Rule of Five, BAS 01123358 has 2 hydrogen bond donor(s) and 5 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 01123358?
The CAS number of BAS 01123358 is 332106-86-2.
What is the molecular formula of BAS 01123358?
The molecular formula of BAS 01123358 is C21H17N3O5.
What is the molecular weight of BAS 01123358?
The molecular weight of BAS 01123358 is 391.12 g/mol.
Where can I buy BAS 01123358?
You can request a quote for BAS 01123358 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01123358?
Yes, KEHONG BIO provides custom synthesis services for BAS 01123358 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.