![1-(2-chlorophenyl)-6-hydroxy-5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one structure](/static/products/118/1189654-90-7.png)
1-(2-chlorophenyl)-6-hydroxy-5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
TL;DR: 1-(2-chlorophenyl)-6-hydroxy-5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one (CAS 1189654-90-7) is a chemical compound with molecular formula C18H14ClN3O4S and molecular weight 403.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-chlorophenyl)-6-hydroxy-5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-1-yl)-2-sulfanylidenepyrimidin-4-one
Also Known As: 1-(2-chlorophenyl)-6-hydroxy-5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one, 1-(2-chlorophenyl)-6-hydroxy-5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-1-yl)-2-sulfanylidenepyrimidin-4-one, 1-(2-chlorophenyl)-6-hydroxy-5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-1-yl)-2-sulfanylpyrimidin-4(1H)-one
| Molecular Formula | C18H14ClN3O4S |
|---|---|
| Molecular Weight | 403.04 g/mol |
| LogP | 3.28271 |
| Topological Polar Surface Area | 100.37 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 403.03937 |
| Heavy Atoms | 27 |
| Complexity | 1188.1998 |
Chemical Identifiers
| CAS Number | 1189654-90-7 |
|---|---|
| SMILES | CC1=NC=C2COC(C2=C1O)C3=C(N(C(=S)NC3=O)C4=CC=CC=C4Cl)O |
Product Overview
1-(2-chlorophenyl)-6-hydroxy-5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one (CAS 1189654-90-7), with molecular formula C18H14ClN3O4S and molecular weight 403.04 g/mol. IUPAC: 1-(2-chlorophenyl)-6-hydroxy-5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-1-yl)-2-sulfanylidenepyrimidin-4-one.
Chemical Property Profile of 1-(2-chlorophenyl)-6-hydroxy-5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Property Insights of 1-(2-chlorophenyl)-6-hydroxy-5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
The XLogP value of 3.28271 indicates that 1-(2-chlorophenyl)-6-hydroxy-5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.37 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-chlorophenyl)-6-hydroxy-5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one. Following Lipinski's Rule of Five, 1-(2-chlorophenyl)-6-hydroxy-5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one has 3 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 1-(2-chlorophenyl)-6-hydroxy-5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one?
The CAS number of 1-(2-chlorophenyl)-6-hydroxy-5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one is 1189654-90-7.
What is the molecular formula of 1-(2-chlorophenyl)-6-hydroxy-5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one?
The molecular formula of 1-(2-chlorophenyl)-6-hydroxy-5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one is C18H14ClN3O4S.
What is the molecular weight of 1-(2-chlorophenyl)-6-hydroxy-5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one?
The molecular weight of 1-(2-chlorophenyl)-6-hydroxy-5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one is 403.04 g/mol.
Where can I buy 1-(2-chlorophenyl)-6-hydroxy-5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one?
You can request a quote for 1-(2-chlorophenyl)-6-hydroxy-5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-chlorophenyl)-6-hydroxy-5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-chlorophenyl)-6-hydroxy-5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.