F1873-2111
TL;DR: F1873-2111 (CAS 872839-63-9) is a chemical compound with molecular formula C17H16N4O5S and molecular weight 388.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[7-(3-methoxyphenyl)-1,3-dimethyl-2,4-dioxopyrimido[4,5-d]pyrimidin-5-yl]sulfanylacetic acid
Also Known As: F1873-2111, 2-((2-(3-methoxyphenyl)-6,8-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl)thio)acetic acid, 2-[7-(3-methoxyphenyl)-1,3-dimethyl-2,4-dioxopyrimido[4,5-d]pyrimidin-5-yl]sulfanylacetic acid, 2-{[2-(3-methoxyphenyl)-6,8-dimethyl-5,7-dioxo-5H,6H,7H,8H-[1,3]diazino[4,5-d]pyrimidin-4-yl]sulfanyl}acetic acid
| Molecular Formula | C17H16N4O5S |
|---|---|
| Molecular Weight | 388.08 g/mol |
| LogP | 0.8795 |
| Topological Polar Surface Area | 116.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 388.08414 |
| Heavy Atoms | 27 |
| Complexity | 1168.4231 |
Chemical Identifiers
| CAS Number | 872839-63-9 |
|---|---|
| SMILES | CN1C2=C(C(=NC(=N2)C3=CC(=CC=C3)OC)SCC(=O)O)C(=O)N(C1=O)C |
Product Overview
F1873-2111 (CAS 872839-63-9), with molecular formula C17H16N4O5S and molecular weight 388.08 g/mol. IUPAC: 2-[7-(3-methoxyphenyl)-1,3-dimethyl-2,4-dioxopyrimido[4,5-d]pyrimidin-5-yl]sulfanylacetic acid.
Chemical Property Profile of F1873-2111
Property Insights of F1873-2111
The XLogP value of 0.8795 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1873-2111. The TPSA of 116.31 Ų falls within the moderate polarity range, balancing permeability and solubility for F1873-2111. Following Lipinski's Rule of Five, F1873-2111 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 F1873-2111?
The CAS number of F1873-2111 is 872839-63-9.
What is the molecular formula of F1873-2111?
The molecular formula of F1873-2111 is C17H16N4O5S.
What is the molecular weight of F1873-2111?
The molecular weight of F1873-2111 is 388.08 g/mol.
Where can I buy F1873-2111?
You can request a quote for F1873-2111 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1873-2111?
Yes, KEHONG BIO provides custom synthesis services for F1873-2111 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.