6-Methyl-5-(pyrrolidin-1-ylsulfonyl)pyrimidine-2,4-diol
TL;DR: 6-Methyl-5-(pyrrolidin-1-ylsulfonyl)pyrimidine-2,4-diol (CAS 90648-86-5) is a chemical compound with molecular formula C9H13N3O4S and molecular weight 259.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-5-pyrrolidin-1-ylsulfonyl-1H-pyrimidine-2,4-dione
Also Known As: 6-methyl-5-pyrrolidin-1-ylsulfonyl-1H-pyrimidine-2,4-dione, 6-methyl-5-(pyrrolidin-1-ylsulfonyl)pyrimidine-2,4(1H,3H)-dione, 6-methyl-5-(pyrrolidin-1-ylsulfonyl)pyrimidine-2,4-diol, 2-hydroxy-6-methyl-5-(pyrrolidin-1-ylsulfonyl)pyrimidin-4(3H)-one, 6-methyl-5-(1-pyrrolidinylsulfonyl)-2,4(1H,3H)-pyrimidinedione
| Molecular Formula | C9H13N3O4S |
|---|---|
| Molecular Weight | 259.06 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 259.06268 |
| Heavy Atoms | 17 |
| Complexity | 497.0 |
Chemical Identifiers
| CAS Number | 90648-86-5 |
|---|---|
| SMILES | CC1=C(C(=O)NC(=O)N1)S(=O)(=O)N2CCCC2 |
| InChIKey | KGPOJUMFFOZFEY-UHFFFAOYSA-N |
Product Overview
6-Methyl-5-(pyrrolidin-1-ylsulfonyl)pyrimidine-2,4-diol (CAS 90648-86-5), with molecular formula C9H13N3O4S and molecular weight 259.06 g/mol. IUPAC: 6-methyl-5-pyrrolidin-1-ylsulfonyl-1H-pyrimidine-2,4-dione.
Chemical Property Profile of 6-Methyl-5-(pyrrolidin-1-ylsulfonyl)pyrimidine-2,4-diol
Property Insights of 6-Methyl-5-(pyrrolidin-1-ylsulfonyl)pyrimidine-2,4-diol
The XLogP value of -0.8 indicates that 6-Methyl-5-(pyrrolidin-1-ylsulfonyl)pyrimidine-2,4-diol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Methyl-5-(pyrrolidin-1-ylsulfonyl)pyrimidine-2,4-diol. Following Lipinski's Rule of Five, 6-Methyl-5-(pyrrolidin-1-ylsulfonyl)pyrimidine-2,4-diol has 2 hydrogen bond donor(s) and 5 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-Methyl-5-(pyrrolidin-1-ylsulfonyl)pyrimidine-2,4-diol?
The CAS number of 6-Methyl-5-(pyrrolidin-1-ylsulfonyl)pyrimidine-2,4-diol is 90648-86-5.
What is the molecular formula of 6-Methyl-5-(pyrrolidin-1-ylsulfonyl)pyrimidine-2,4-diol?
The molecular formula of 6-Methyl-5-(pyrrolidin-1-ylsulfonyl)pyrimidine-2,4-diol is C9H13N3O4S.
What is the molecular weight of 6-Methyl-5-(pyrrolidin-1-ylsulfonyl)pyrimidine-2,4-diol?
The molecular weight of 6-Methyl-5-(pyrrolidin-1-ylsulfonyl)pyrimidine-2,4-diol is 259.06 g/mol.
Where can I buy 6-Methyl-5-(pyrrolidin-1-ylsulfonyl)pyrimidine-2,4-diol?
You can request a quote for 6-Methyl-5-(pyrrolidin-1-ylsulfonyl)pyrimidine-2,4-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Methyl-5-(pyrrolidin-1-ylsulfonyl)pyrimidine-2,4-diol?
Yes, KEHONG BIO provides custom synthesis services for 6-Methyl-5-(pyrrolidin-1-ylsulfonyl)pyrimidine-2,4-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.