F0820-0078
TL;DR: F0820-0078 (CAS 397290-99-2) is a chemical compound with molecular formula C20H20ClN5O and molecular weight 381.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-3-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]urea
Also Known As: F0820-0078, 1-(4-chlorophenyl)-3-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]urea, 3-{p-[3-(p-chlorophenyl)ureido]phenyl}-1,2,3a-triaza-5,6,7,8-tetrahydro-4H-azulene, 1-(4-chlorophenyl)-3-(4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl)urea, N-(4-(5H,6H,7H,8H,9H-1,2,4-triazolo[4,5-a]azaperhydroepin-3-yl)phenyl)[(4-chlo rophenyl)amino]carboxamide
| Molecular Formula | C20H20ClN5O |
|---|---|
| Molecular Weight | 381.14 g/mol |
| LogP | 4.9689 |
| Topological Polar Surface Area | 71.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 381.13565 |
| Heavy Atoms | 27 |
| Complexity | 934.01086 |
Chemical Identifiers
| CAS Number | 397290-99-2 |
|---|---|
| SMILES | C1CCC2=NN=C(N2CC1)C3=CC=C(C=C3)NC(=O)NC4=CC=C(C=C4)Cl |
Product Overview
F0820-0078 (CAS 397290-99-2), with molecular formula C20H20ClN5O and molecular weight 381.14 g/mol. IUPAC: 1-(4-chlorophenyl)-3-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]urea.
Chemical Property Profile of F0820-0078
Property Insights of F0820-0078
The XLogP value of 4.9689 indicates that F0820-0078 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.84 Ų falls within the moderate polarity range, balancing permeability and solubility for F0820-0078. Following Lipinski's Rule of Five, F0820-0078 has 2 hydrogen bond donor(s) and 3 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 F0820-0078?
The CAS number of F0820-0078 is 397290-99-2.
What is the molecular formula of F0820-0078?
The molecular formula of F0820-0078 is C20H20ClN5O.
What is the molecular weight of F0820-0078?
The molecular weight of F0820-0078 is 381.14 g/mol.
Where can I buy F0820-0078?
You can request a quote for F0820-0078 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0820-0078?
Yes, KEHONG BIO provides custom synthesis services for F0820-0078 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.