![4-(Benzylsulfanyl)-2-(4-fluorophenyl)-7-methyl-5H-chromeno[2,3-D]pyrimidine structure](/static/products/895/895640-06-9.png)
4-(Benzylsulfanyl)-2-(4-fluorophenyl)-7-methyl-5H-chromeno[2,3-D]pyrimidine
TL;DR: 4-(Benzylsulfanyl)-2-(4-fluorophenyl)-7-methyl-5H-chromeno[2,3-D]pyrimidine (CAS 895640-06-9) is a chemical compound with molecular formula C25H19FN2OS and molecular weight 414.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-benzylsulfanyl-2-(4-fluorophenyl)-7-methyl-5H-chromeno[2,3-d]pyrimidine
Also Known As: 4-(BENZYLSULFANYL)-2-(4-FLUOROPHENYL)-7-METHYL-5H-CHROMENO[2,3-D]PYRIMIDINE, F1609-0734, 4-(benzylthio)-2-(4-fluorophenyl)-7-methyl-5H-chromeno[2,3-d]pyrimidine, 4-benzylsulfanyl-2-(4-fluorophenyl)-7-methyl-5H-chromeno[2,3-d]pyrimidine
| Molecular Formula | C25H19FN2OS |
|---|---|
| Molecular Weight | 414.12 g/mol |
| LogP | 6.57992 |
| Topological Polar Surface Area | 35.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 414.1202 |
| Heavy Atoms | 30 |
| Complexity | 1210.0039 |
Chemical Identifiers
| CAS Number | 895640-06-9 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)OC3=C(C2)C(=NC(=N3)C4=CC=C(C=C4)F)SCC5=CC=CC=C5 |
Product Overview
4-(Benzylsulfanyl)-2-(4-fluorophenyl)-7-methyl-5H-chromeno[2,3-D]pyrimidine (CAS 895640-06-9), with molecular formula C25H19FN2OS and molecular weight 414.12 g/mol. IUPAC: 4-benzylsulfanyl-2-(4-fluorophenyl)-7-methyl-5H-chromeno[2,3-d]pyrimidine.
Chemical Property Profile of 4-(Benzylsulfanyl)-2-(4-fluorophenyl)-7-methyl-5H-chromeno[2,3-D]pyrimidine
Property Insights of 4-(Benzylsulfanyl)-2-(4-fluorophenyl)-7-methyl-5H-chromeno[2,3-D]pyrimidine
The XLogP value of 6.57992 indicates that 4-(Benzylsulfanyl)-2-(4-fluorophenyl)-7-methyl-5H-chromeno[2,3-D]pyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.01 Ų, 4-(Benzylsulfanyl)-2-(4-fluorophenyl)-7-methyl-5H-chromeno[2,3-D]pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Benzylsulfanyl)-2-(4-fluorophenyl)-7-methyl-5H-chromeno[2,3-D]pyrimidine has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(Benzylsulfanyl)-2-(4-fluorophenyl)-7-methyl-5H-chromeno[2,3-D]pyrimidine?
The CAS number of 4-(Benzylsulfanyl)-2-(4-fluorophenyl)-7-methyl-5H-chromeno[2,3-D]pyrimidine is 895640-06-9.
What is the molecular formula of 4-(Benzylsulfanyl)-2-(4-fluorophenyl)-7-methyl-5H-chromeno[2,3-D]pyrimidine?
The molecular formula of 4-(Benzylsulfanyl)-2-(4-fluorophenyl)-7-methyl-5H-chromeno[2,3-D]pyrimidine is C25H19FN2OS.
What is the molecular weight of 4-(Benzylsulfanyl)-2-(4-fluorophenyl)-7-methyl-5H-chromeno[2,3-D]pyrimidine?
The molecular weight of 4-(Benzylsulfanyl)-2-(4-fluorophenyl)-7-methyl-5H-chromeno[2,3-D]pyrimidine is 414.12 g/mol.
Where can I buy 4-(Benzylsulfanyl)-2-(4-fluorophenyl)-7-methyl-5H-chromeno[2,3-D]pyrimidine?
You can request a quote for 4-(Benzylsulfanyl)-2-(4-fluorophenyl)-7-methyl-5H-chromeno[2,3-D]pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Benzylsulfanyl)-2-(4-fluorophenyl)-7-methyl-5H-chromeno[2,3-D]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4-(Benzylsulfanyl)-2-(4-fluorophenyl)-7-methyl-5H-chromeno[2,3-D]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.