BAS 02234391
TL;DR: BAS 02234391 (CAS 406711-07-7) is a chemical compound with molecular formula C21H23N3O6 and molecular weight 413.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-N-[(Z)-3-(3-methoxypropylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
Also Known As: BAS 02234391, BIM-0003385.P001, 4-methoxy-N-[(Z)-3-(3-methoxypropylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide, 4-MEO-N-(1-(((3-METHOXYPROPYL)AMINO)CARBONYL)-2-(3-NITROPHENYL)VINYL)BENZAMIDE, 4-Methoxy-N-[1-(3-methoxy-propylcarbamoyl)-2-(3-nitro-phenyl)-vinyl]-benzamide
| Molecular Formula | C21H23N3O6 |
|---|---|
| Molecular Weight | 413.16 g/mol |
| LogP | 2.527 |
| Topological Polar Surface Area | 119.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 413.1587 |
| Heavy Atoms | 30 |
| Complexity | 924.5939 |
Chemical Identifiers
| CAS Number | 406711-07-7 |
|---|---|
| SMILES | COCCCNC(=O)/C(=C/C1=CC(=CC=C1)[N+](=O)[O-])/NC(=O)C2=CC=C(C=C2)OC |
Product Overview
BAS 02234391 (CAS 406711-07-7), with molecular formula C21H23N3O6 and molecular weight 413.16 g/mol. IUPAC: 4-methoxy-N-[(Z)-3-(3-methoxypropylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide.
Chemical Property Profile of BAS 02234391
Property Insights of BAS 02234391
The XLogP value of 2.527 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 02234391. The TPSA of 119.8 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02234391. Following Lipinski's Rule of Five, BAS 02234391 has 2 hydrogen bond donor(s) and 6 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 02234391?
The CAS number of BAS 02234391 is 406711-07-7.
What is the molecular formula of BAS 02234391?
The molecular formula of BAS 02234391 is C21H23N3O6.
What is the molecular weight of BAS 02234391?
The molecular weight of BAS 02234391 is 413.16 g/mol.
Where can I buy BAS 02234391?
You can request a quote for BAS 02234391 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02234391?
Yes, KEHONG BIO provides custom synthesis services for BAS 02234391 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.