ethyl 4-amino-2-oxo-1-(2,3,5-tri-o-benzoylpentofuranosyl)-1,2-dihydropyrimidine-5-carboxylate
TL;DR: ethyl 4-amino-2-oxo-1-(2,3,5-tri-o-benzoylpentofuranosyl)-1,2-dihydropyrimidine-5-carboxylate (CAS 65174-72-3) is a chemical compound with molecular formula C33H29N3O10 and molecular weight 627.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-amino-1-[3,4-dibenzoyloxy-5-(benzoyloxymethyl)oxolan-2-yl]-2-oxopyrimidine-5-carboxylate
Also Known As: ethyl 4-amino-2-oxo-1-(2,3,5-tri-o-benzoylpentofuranosyl)-1,2-dihydropyrimidine-5-carboxylate, ethyl 4-amino-1-[3,4-dibenzoyloxy-5-(benzoyloxymethyl)oxolan-2-yl]-2-oxopyrimidine-5-carboxylate
| Molecular Formula | C33H29N3O10 |
|---|---|
| Molecular Weight | 627.19 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 173.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 14 |
| Exact Mass | 627.1853 |
| Heavy Atoms | 46 |
| Complexity | 1200.0 |
Chemical Identifiers
| CAS Number | 65174-72-3 |
|---|---|
| SMILES | CCOC(=O)C1=CN(C(=O)N=C1N)C2C(C(C(O2)COC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5 |
| InChIKey | XPOGVBWLJMTJRZ-UHFFFAOYSA-N |
Product Overview
ethyl 4-amino-2-oxo-1-(2,3,5-tri-o-benzoylpentofuranosyl)-1,2-dihydropyrimidine-5-carboxylate (CAS 65174-72-3), with molecular formula C33H29N3O10 and molecular weight 627.19 g/mol. IUPAC: ethyl 4-amino-1-[3,4-dibenzoyloxy-5-(benzoyloxymethyl)oxolan-2-yl]-2-oxopyrimidine-5-carboxylate.
Chemical Property Profile of ethyl 4-amino-2-oxo-1-(2,3,5-tri-o-benzoylpentofuranosyl)-1,2-dihydropyrimidine-5-carboxylate
Property Insights of ethyl 4-amino-2-oxo-1-(2,3,5-tri-o-benzoylpentofuranosyl)-1,2-dihydropyrimidine-5-carboxylate
The XLogP value of 5.2 indicates that ethyl 4-amino-2-oxo-1-(2,3,5-tri-o-benzoylpentofuranosyl)-1,2-dihydropyrimidine-5-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 173.0 Ų indicates high polarity, suggesting ethyl 4-amino-2-oxo-1-(2,3,5-tri-o-benzoylpentofuranosyl)-1,2-dihydropyrimidine-5-carboxylate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ethyl 4-amino-2-oxo-1-(2,3,5-tri-o-benzoylpentofuranosyl)-1,2-dihydropyrimidine-5-carboxylate has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ethyl 4-amino-2-oxo-1-(2,3,5-tri-o-benzoylpentofuranosyl)-1,2-dihydropyrimidine-5-carboxylate?
The CAS number of ethyl 4-amino-2-oxo-1-(2,3,5-tri-o-benzoylpentofuranosyl)-1,2-dihydropyrimidine-5-carboxylate is 65174-72-3.
What is the molecular formula of ethyl 4-amino-2-oxo-1-(2,3,5-tri-o-benzoylpentofuranosyl)-1,2-dihydropyrimidine-5-carboxylate?
The molecular formula of ethyl 4-amino-2-oxo-1-(2,3,5-tri-o-benzoylpentofuranosyl)-1,2-dihydropyrimidine-5-carboxylate is C33H29N3O10.
What is the molecular weight of ethyl 4-amino-2-oxo-1-(2,3,5-tri-o-benzoylpentofuranosyl)-1,2-dihydropyrimidine-5-carboxylate?
The molecular weight of ethyl 4-amino-2-oxo-1-(2,3,5-tri-o-benzoylpentofuranosyl)-1,2-dihydropyrimidine-5-carboxylate is 627.19 g/mol.
Where can I buy ethyl 4-amino-2-oxo-1-(2,3,5-tri-o-benzoylpentofuranosyl)-1,2-dihydropyrimidine-5-carboxylate?
You can request a quote for ethyl 4-amino-2-oxo-1-(2,3,5-tri-o-benzoylpentofuranosyl)-1,2-dihydropyrimidine-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 4-amino-2-oxo-1-(2,3,5-tri-o-benzoylpentofuranosyl)-1,2-dihydropyrimidine-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-amino-2-oxo-1-(2,3,5-tri-o-benzoylpentofuranosyl)-1,2-dihydropyrimidine-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.