F0913-4222
TL;DR: F0913-4222 (CAS 450372-91-5) is a chemical compound with molecular formula C25H21Cl2N3O4 and molecular weight 497.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-1-(3,4-dichlorophenyl)-3-oxo-3-(6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl)prop-1-en-2-yl]furan-2-carboxamide
Also Known As: F0913-4222, (E)-N-(1-(3,4-dichlorophenyl)-3-oxo-3-(8-oxo-5,6-dihydro-1H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(2H,4H,8H)-yl)prop-1-en-2-yl)furan-2-carboxamide, N-[(1E)-1-(3,4-dichlorophenyl)-3-oxo-3-{6-oxo-7,11-diazatricyclo[7.3.1.0^{2,7}]trideca-2,4-dien-11-yl}prop-1-en-2-yl]furan-2-carboxamide, N-[(E)-1-(3,4-dichlorophenyl)-3-oxo-3-(6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl)prop-1-en-2-yl]furan-2-carboxamide, N-[(E)-2-(3,4-dichlorophenyl)-1-[(6-oxo-7,11-diazatricyclo[7.3.1.0(2),]trideca-2,4-dien-11-yl)carbonyl]ethenyl]-2-furamide
| Molecular Formula | C25H21Cl2N3O4 |
|---|---|
| Molecular Weight | 497.09 g/mol |
| LogP | 4.1649 |
| Topological Polar Surface Area | 84.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 497.0909 |
| Heavy Atoms | 34 |
| Complexity | 1346.4407 |
Chemical Identifiers
| CAS Number | 450372-91-5 |
|---|---|
| SMILES | C1C2CN(CC1C3=CC=CC(=O)N3C2)C(=O)/C(=C\C4=CC(=C(C=C4)Cl)Cl)/NC(=O)C5=CC=CO5 |
Product Overview
F0913-4222 (CAS 450372-91-5), with molecular formula C25H21Cl2N3O4 and molecular weight 497.09 g/mol. IUPAC: N-[(E)-1-(3,4-dichlorophenyl)-3-oxo-3-(6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl)prop-1-en-2-yl]furan-2-carboxamide.
Chemical Property Profile of F0913-4222
Property Insights of F0913-4222
The XLogP value of 4.1649 indicates that F0913-4222 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.55 Ų falls within the moderate polarity range, balancing permeability and solubility for F0913-4222. Following Lipinski's Rule of Five, F0913-4222 has 1 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 F0913-4222?
The CAS number of F0913-4222 is 450372-91-5.
What is the molecular formula of F0913-4222?
The molecular formula of F0913-4222 is C25H21Cl2N3O4.
What is the molecular weight of F0913-4222?
The molecular weight of F0913-4222 is 497.09 g/mol.
Where can I buy F0913-4222?
You can request a quote for F0913-4222 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0913-4222?
Yes, KEHONG BIO provides custom synthesis services for F0913-4222 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.