F0801-0014
TL;DR: F0801-0014 (CAS 397283-16-8) is a chemical compound with molecular formula C18H18ClN7O4 and molecular weight 431.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[(2Z)-2-[(Z)-2-chloro-3-(4-nitrophenyl)prop-2-enylidene]hydrazinyl]-7-ethyl-1,3-dimethylpurine-2,6-dione
Also Known As: F0801-0014, 8-[(2Z)-2-[(Z)-2-chloro-3-(4-nitrophenyl)prop-2-enylidene]hydrazinyl]-7-ethyl-1,3-dimethylpurine-2,6-dione, (1Z,2Z)-2-chloro-3-(4-nitrophenyl)acrylaldehyde (7-ethyl-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)hydrazone, 8-((Z)-2-((Z)-2-chloro-3-(4-nitrophenyl)allylidene)hydrazinyl)-7-ethyl-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione, 8-[(2Z)-2-[(2Z)-2-CHLORO-3-(4-NITROPHENYL)PROP-2-EN-1-YLIDENE]HYDRAZIN-1-YL]-7-ETHYL-1,3-DIMETHYL-2,3,6,7-TETRAHYDRO-1H-PURINE-2,6-DIONE
| Molecular Formula | C18H18ClN7O4 |
|---|---|
| Molecular Weight | 431.11 g/mol |
| LogP | 2.0394 |
| Topological Polar Surface Area | 129.35 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 431.11087 |
| Heavy Atoms | 30 |
| Complexity | 1299.2917 |
Chemical Identifiers
| CAS Number | 397283-16-8 |
|---|---|
| SMILES | CCN1C2=C(N=C1N/N=C\C(=C\C3=CC=C(C=C3)[N+](=O)[O-])\Cl)N(C(=O)N(C2=O)C)C |
Product Overview
F0801-0014 (CAS 397283-16-8), with molecular formula C18H18ClN7O4 and molecular weight 431.11 g/mol. IUPAC: 8-[(2Z)-2-[(Z)-2-chloro-3-(4-nitrophenyl)prop-2-enylidene]hydrazinyl]-7-ethyl-1,3-dimethylpurine-2,6-dione.
Chemical Property Profile of F0801-0014
Property Insights of F0801-0014
The XLogP value of 2.0394 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0801-0014. The TPSA of 129.35 Ų falls within the moderate polarity range, balancing permeability and solubility for F0801-0014. Following Lipinski's Rule of Five, F0801-0014 has 1 hydrogen bond donor(s) and 7 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 F0801-0014?
The CAS number of F0801-0014 is 397283-16-8.
What is the molecular formula of F0801-0014?
The molecular formula of F0801-0014 is C18H18ClN7O4.
What is the molecular weight of F0801-0014?
The molecular weight of F0801-0014 is 431.11 g/mol.
Where can I buy F0801-0014?
You can request a quote for F0801-0014 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0801-0014?
Yes, KEHONG BIO provides custom synthesis services for F0801-0014 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.