F1873-1175
TL;DR: F1873-1175 (CAS 872694-56-9) is a chemical compound with molecular formula C21H25N5O2S and molecular weight 411.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethyl-7-(4-methylphenyl)-5-(2-pyrrolidin-1-ylethylsulfanyl)pyrimido[4,5-d]pyrimidine-2,4-dione
Also Known As: F1873-1175, 1,3-dimethyl-5-((2-(pyrrolidin-1-yl)ethyl)thio)-7-(p-tolyl)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione, 1,3-dimethyl-7-(4-methylphenyl)-5-(2-pyrrolidin-1-ylethylsulfanyl)pyrimido[4,5-d]pyrimidine-2,4-dione, 1,3-dimethyl-7-(4-methylphenyl)-5-{[2-(pyrrolidin-1-yl)ethyl]sulfanyl}-1H,2H,3H,4H-[1,3]diazino[4,5-d]pyrimidine-2,4-dione
| Molecular Formula | C21H25N5O2S |
|---|---|
| Molecular Weight | 411.17 g/mol |
| LogP | 2.19052 |
| Topological Polar Surface Area | 73.02 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 411.17288 |
| Heavy Atoms | 29 |
| Complexity | 1160.8806 |
Chemical Identifiers
| CAS Number | 872694-56-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NC3=C(C(=N2)SCCN4CCCC4)C(=O)N(C(=O)N3C)C |
Product Overview
F1873-1175 (CAS 872694-56-9), with molecular formula C21H25N5O2S and molecular weight 411.17 g/mol. IUPAC: 1,3-dimethyl-7-(4-methylphenyl)-5-(2-pyrrolidin-1-ylethylsulfanyl)pyrimido[4,5-d]pyrimidine-2,4-dione.
Chemical Property Profile of F1873-1175
Property Insights of F1873-1175
The XLogP value of 2.19052 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1873-1175. The TPSA of 73.02 Ų falls within the moderate polarity range, balancing permeability and solubility for F1873-1175. Following Lipinski's Rule of Five, F1873-1175 has 0 hydrogen bond donor(s) and 6 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 F1873-1175?
The CAS number of F1873-1175 is 872694-56-9.
What is the molecular formula of F1873-1175?
The molecular formula of F1873-1175 is C21H25N5O2S.
What is the molecular weight of F1873-1175?
The molecular weight of F1873-1175 is 411.17 g/mol.
Where can I buy F1873-1175?
You can request a quote for F1873-1175 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1873-1175?
Yes, KEHONG BIO provides custom synthesis services for F1873-1175 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.