F3124-0976
TL;DR: F3124-0976 (CAS 887197-41-3) is a chemical compound with molecular formula C22H29N5O3 and molecular weight 411.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-butyl-10-(4-ethoxyphenyl)-1-methyl-6,7,8,9-tetrahydropurino[7,8-a][1,3]diazepine-2,4-dione
Also Known As: F3124-0976, 3-butyl-10-(4-ethoxyphenyl)-1-methyl-1H,2H,3H,4H,6H,7H,8H,9H,10H-[1,3]diazepino[1,2-g]purine-2,4-dione, 3-butyl-10-(4-ethoxyphenyl)-1-methyl-6,7,8,9-tetrahydropurino[7,8-a][1,3]diazepine-2,4-dione, 3-butyl-10-(4-ethoxyphenyl)-1-methyl-7,8,9,10-tetrahydro-1H-[1,3]diazepino[2,1-f]purine-2,4(3H,6H)-dione, 3-butyl-10-(4-ethoxyphenyl)-1-methyl-1,3,5-trihydro-6H,7H,8H,9H-1,3-diazaperhy droepino[1,2-h]purine-2,4-dione
| Molecular Formula | C22H29N5O3 |
|---|---|
| Molecular Weight | 411.23 g/mol |
| LogP | 3.0274 |
| Topological Polar Surface Area | 74.29 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 411.22705 |
| Heavy Atoms | 30 |
| Complexity | 1156.7053 |
Chemical Identifiers
| CAS Number | 887197-41-3 |
|---|---|
| SMILES | CCCCN1C(=O)C2=C(N=C3N2CCCCN3C4=CC=C(C=C4)OCC)N(C1=O)C |
Product Overview
F3124-0976 (CAS 887197-41-3), with molecular formula C22H29N5O3 and molecular weight 411.23 g/mol. IUPAC: 3-butyl-10-(4-ethoxyphenyl)-1-methyl-6,7,8,9-tetrahydropurino[7,8-a][1,3]diazepine-2,4-dione.
Chemical Property Profile of F3124-0976
Property Insights of F3124-0976
The XLogP value of 3.0274 indicates that F3124-0976 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.29 Ų falls within the moderate polarity range, balancing permeability and solubility for F3124-0976. Following Lipinski's Rule of Five, F3124-0976 has 0 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 F3124-0976?
The CAS number of F3124-0976 is 887197-41-3.
What is the molecular formula of F3124-0976?
The molecular formula of F3124-0976 is C22H29N5O3.
What is the molecular weight of F3124-0976?
The molecular weight of F3124-0976 is 411.23 g/mol.
Where can I buy F3124-0976?
You can request a quote for F3124-0976 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3124-0976?
Yes, KEHONG BIO provides custom synthesis services for F3124-0976 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.