6-(dimethoxymethyl)-5-[(2-hydroxy-5-nitrophenyl)methyl]-2-su
TL;DR: 6-(dimethoxymethyl)-5-[(2-hydroxy-5-nitrophenyl)methyl]-2-su (CAS 31349-18-5) is a chemical compound with molecular formula C14H15N3O6S and molecular weight 353.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(dimethoxymethyl)-5-[(2-hydroxy-5-nitrophenyl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one
Also Known As: 6-(dimethoxymethyl)-5-[(2-hydroxy-5-nitrophenyl)methyl]-2-su, 6-(dimethoxymethyl)-5-[(2-hydroxy-5-nitrophenyl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one, 6-(Dimethoxymethyl)-5-[(2-hydroxy-5-nitrophenyl)methyl]-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one
| Molecular Formula | C14H15N3O6S |
|---|---|
| Molecular Weight | 353.07 g/mol |
| LogP | 1.92849 |
| Topological Polar Surface Area | 130.48 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 353.06815 |
| Heavy Atoms | 24 |
| Complexity | 871.544 |
Chemical Identifiers
| CAS Number | 31349-18-5 |
|---|---|
| SMILES | COC(C1=C(C(=O)NC(=S)N1)CC2=C(C=CC(=C2)[N+](=O)[O-])O)OC |
Product Overview
6-(dimethoxymethyl)-5-[(2-hydroxy-5-nitrophenyl)methyl]-2-su (CAS 31349-18-5), with molecular formula C14H15N3O6S and molecular weight 353.07 g/mol. IUPAC: 6-(dimethoxymethyl)-5-[(2-hydroxy-5-nitrophenyl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one.
Chemical Property Profile of 6-(dimethoxymethyl)-5-[(2-hydroxy-5-nitrophenyl)methyl]-2-su
Property Insights of 6-(dimethoxymethyl)-5-[(2-hydroxy-5-nitrophenyl)methyl]-2-su
The XLogP value of 1.92849 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(dimethoxymethyl)-5-[(2-hydroxy-5-nitrophenyl)methyl]-2-su. The TPSA of 130.48 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(dimethoxymethyl)-5-[(2-hydroxy-5-nitrophenyl)methyl]-2-su. Following Lipinski's Rule of Five, 6-(dimethoxymethyl)-5-[(2-hydroxy-5-nitrophenyl)methyl]-2-su has 3 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 6-(dimethoxymethyl)-5-[(2-hydroxy-5-nitrophenyl)methyl]-2-su?
The CAS number of 6-(dimethoxymethyl)-5-[(2-hydroxy-5-nitrophenyl)methyl]-2-su is 31349-18-5.
What is the molecular formula of 6-(dimethoxymethyl)-5-[(2-hydroxy-5-nitrophenyl)methyl]-2-su?
The molecular formula of 6-(dimethoxymethyl)-5-[(2-hydroxy-5-nitrophenyl)methyl]-2-su is C14H15N3O6S.
What is the molecular weight of 6-(dimethoxymethyl)-5-[(2-hydroxy-5-nitrophenyl)methyl]-2-su?
The molecular weight of 6-(dimethoxymethyl)-5-[(2-hydroxy-5-nitrophenyl)methyl]-2-su is 353.07 g/mol.
Where can I buy 6-(dimethoxymethyl)-5-[(2-hydroxy-5-nitrophenyl)methyl]-2-su?
You can request a quote for 6-(dimethoxymethyl)-5-[(2-hydroxy-5-nitrophenyl)methyl]-2-su directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(dimethoxymethyl)-5-[(2-hydroxy-5-nitrophenyl)methyl]-2-su?
Yes, KEHONG BIO provides custom synthesis services for 6-(dimethoxymethyl)-5-[(2-hydroxy-5-nitrophenyl)methyl]-2-su and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.