4-amino-8-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylsulfanyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxamide
TL;DR: 4-amino-8-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylsulfanyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxamide (CAS 36707-04-7) is a chemical compound with molecular formula C14H17N5O6S and molecular weight 383.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-8-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylsulfanyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxamide
Also Known As: 4-amino-8-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylsulfanyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxamide, 4-Amino-2-(methylsulfanyl)-5-oxo-8-pentofuranosyl-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxamide
| Molecular Formula | C14H17N5O6S |
|---|---|
| Molecular Weight | 383.09 g/mol |
| LogP | -1.1 |
| Topological Polar Surface Area | 210.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 4 |
| Exact Mass | 383.08997 |
| Heavy Atoms | 26 |
| Complexity | 621.0 |
Chemical Identifiers
| CAS Number | 36707-04-7 |
|---|---|
| SMILES | CSC1=NC(=C2C(=O)C(=CN(C2=N1)C3C(C(C(O3)CO)O)O)C(=O)N)N |
| InChIKey | XUSALNXBQOJHFT-UHFFFAOYSA-N |
Product Overview
4-amino-8-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylsulfanyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxamide (CAS 36707-04-7), with molecular formula C14H17N5O6S and molecular weight 383.09 g/mol. IUPAC: 4-amino-8-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylsulfanyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxamide.
Chemical Property Profile of 4-amino-8-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylsulfanyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxamide
Property Insights of 4-amino-8-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylsulfanyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxamide
The XLogP value of -1.1 indicates that 4-amino-8-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylsulfanyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 210.0 Ų indicates high polarity, suggesting 4-amino-8-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylsulfanyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-amino-8-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylsulfanyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxamide has 5 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-amino-8-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylsulfanyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxamide?
The CAS number of 4-amino-8-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylsulfanyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxamide is 36707-04-7.
What is the molecular formula of 4-amino-8-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylsulfanyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxamide?
The molecular formula of 4-amino-8-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylsulfanyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxamide is C14H17N5O6S.
What is the molecular weight of 4-amino-8-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylsulfanyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxamide?
The molecular weight of 4-amino-8-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylsulfanyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxamide is 383.09 g/mol.
Where can I buy 4-amino-8-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylsulfanyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxamide?
You can request a quote for 4-amino-8-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylsulfanyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-amino-8-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylsulfanyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 4-amino-8-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-methylsulfanyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.