BAS 01123346
TL;DR: BAS 01123346 (CAS 332106-76-0) is a chemical compound with molecular formula C17H17BrN2O4 and molecular weight 392.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-1-(4-bromophenyl)-3-(3-hydroxypropylamino)-3-oxoprop-1-en-2-yl]furan-2-carboxamide
Also Known As: BAS 01123346, (E)-N-(1-(4-bromophenyl)-3-((3-hydroxypropyl)amino)-3-oxoprop-1-en-2-yl)furan-2-carboxamide, N-[(E)-1-(4-bromophenyl)-3-(3-hydroxypropylamino)-3-oxoprop-1-en-2-yl]furan-2-carboxamide, N-{(1E)-1-(4-bromophenyl)-3-[(3-hydroxypropyl)amino]-3-oxoprop-1-en-2-yl}furan-2-carboxamide
| Molecular Formula | C17H17BrN2O4 |
|---|---|
| Molecular Weight | 392.04 g/mol |
| LogP | 2.3116 |
| Topological Polar Surface Area | 91.57 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 392.03717 |
| Heavy Atoms | 24 |
| Complexity | 708.7016 |
Chemical Identifiers
| CAS Number | 332106-76-0 |
|---|---|
| SMILES | C1=COC(=C1)C(=O)N/C(=C/C2=CC=C(C=C2)Br)/C(=O)NCCCO |
Product Overview
BAS 01123346 (CAS 332106-76-0), with molecular formula C17H17BrN2O4 and molecular weight 392.04 g/mol. IUPAC: N-[(E)-1-(4-bromophenyl)-3-(3-hydroxypropylamino)-3-oxoprop-1-en-2-yl]furan-2-carboxamide.
Chemical Property Profile of BAS 01123346
Property Insights of BAS 01123346
The XLogP value of 2.3116 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01123346. The TPSA of 91.57 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01123346. Following Lipinski's Rule of Five, BAS 01123346 has 3 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 01123346?
The CAS number of BAS 01123346 is 332106-76-0.
What is the molecular formula of BAS 01123346?
The molecular formula of BAS 01123346 is C17H17BrN2O4.
What is the molecular weight of BAS 01123346?
The molecular weight of BAS 01123346 is 392.04 g/mol.
Where can I buy BAS 01123346?
You can request a quote for BAS 01123346 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01123346?
Yes, KEHONG BIO provides custom synthesis services for BAS 01123346 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.