F3345-0189
TL;DR: F3345-0189 (CAS 896835-96-4) is a chemical compound with molecular formula C25H18N4O4 and molecular weight 438.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-yl)-6-benzyl-2-oxo-1,6,8-triazatricyclo[7.4.0.03,7]trideca-3(7),4,8,10,12-pentaene-5-carboxamide
Also Known As: F3345-0189, N-(2H-1,3-benzodioxol-5-yl)-6-benzyl-2-oxo-1,6,8-triazatricyclo[7.4.0.0^{3,7}]trideca-3(7),4,8,10,12-pentaene-5-carboxamide, N-(benzo[d][1,3]dioxol-5-yl)-1-benzyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide, N-(1,3-benzodioxol-5-yl)-1-benzyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide, N-(1,3-Benzodioxol-5-yl)-6-benzyl-2-oxo-1,6,8-triazatricyclo[7.4.0.03,7]trideca-3(7),4,8,10,12-pentaene-5-carboxamide
| Molecular Formula | C25H18N4O4 |
|---|---|
| Molecular Weight | 438.13 g/mol |
| LogP | 3.6785 |
| Topological Polar Surface Area | 86.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 438.1328 |
| Heavy Atoms | 33 |
| Complexity | 1587.4574 |
Chemical Identifiers
| CAS Number | 896835-96-4 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)NC(=O)C3=CC4=C(N3CC5=CC=CC=C5)N=C6C=CC=CN6C4=O |
Product Overview
F3345-0189 (CAS 896835-96-4), with molecular formula C25H18N4O4 and molecular weight 438.13 g/mol. IUPAC: N-(1,3-benzodioxol-5-yl)-6-benzyl-2-oxo-1,6,8-triazatricyclo[7.4.0.03,7]trideca-3(7),4,8,10,12-pentaene-5-carboxamide.
Chemical Property Profile of F3345-0189
Property Insights of F3345-0189
The XLogP value of 3.6785 indicates that F3345-0189 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.86 Ų falls within the moderate polarity range, balancing permeability and solubility for F3345-0189. Following Lipinski's Rule of Five, F3345-0189 has 1 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 F3345-0189?
The CAS number of F3345-0189 is 896835-96-4.
What is the molecular formula of F3345-0189?
The molecular formula of F3345-0189 is C25H18N4O4.
What is the molecular weight of F3345-0189?
The molecular weight of F3345-0189 is 438.13 g/mol.
Where can I buy F3345-0189?
You can request a quote for F3345-0189 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3345-0189?
Yes, KEHONG BIO provides custom synthesis services for F3345-0189 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.