2,4(1H,3H)-Pyrimidinedione, dihydro-6-(acetyloxy)-5-methyl-5-nitro-
TL;DR: 2,4(1H,3H)-Pyrimidinedione, dihydro-6-(acetyloxy)-5-methyl-5-nitro- (CAS 82531-52-0) is a chemical compound with molecular formula C7H9N3O6 and molecular weight 231.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-methyl-5-nitro-2,6-dioxo-1,3-diazinan-4-yl) acetate
Also Known As: 4-Acetyloxy-5-nitro-4,5-dihydrothymine, 2,4(1H,3H)-Pyrimidinedione, dihydro-6-(acetyloxy)-5-methyl-5-nitro-, Dihydro-6-(acetyloxy)-5-methyl-5-nitro-2,4(1H,3H)-pyrimidinedione, (5-methyl-5-nitro-2,6-dioxo-1,3-diazinan-4-yl) acetate, 2,4(1H,3H)-Pyrimidinedione, 6-(benzoyloxy)dihydro-5-methyl-5-nitro-
| Molecular Formula | C7H9N3O6 |
|---|---|
| Molecular Weight | 231.05 g/mol |
| LogP | -1.2496 |
| Topological Polar Surface Area | 127.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 231.04913 |
| Heavy Atoms | 16 |
| Complexity | 378.31845 |
Chemical Identifiers
| CAS Number | 82531-52-0 |
|---|---|
| SMILES | CC(=O)OC1C(C(=O)NC(=O)N1)(C)[N+](=O)[O-] |
Product Overview
2,4(1H,3H)-Pyrimidinedione, dihydro-6-(acetyloxy)-5-methyl-5-nitro- (CAS 82531-52-0), with molecular formula C7H9N3O6 and molecular weight 231.05 g/mol. IUPAC: (5-methyl-5-nitro-2,6-dioxo-1,3-diazinan-4-yl) acetate.
Chemical Property Profile of 2,4(1H,3H)-Pyrimidinedione, dihydro-6-(acetyloxy)-5-methyl-5-nitro-
Property Insights of 2,4(1H,3H)-Pyrimidinedione, dihydro-6-(acetyloxy)-5-methyl-5-nitro-
The XLogP value of -1.2496 indicates that 2,4(1H,3H)-Pyrimidinedione, dihydro-6-(acetyloxy)-5-methyl-5-nitro- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 127.64 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4(1H,3H)-Pyrimidinedione, dihydro-6-(acetyloxy)-5-methyl-5-nitro-. Following Lipinski's Rule of Five, 2,4(1H,3H)-Pyrimidinedione, dihydro-6-(acetyloxy)-5-methyl-5-nitro- has 2 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 2,4(1H,3H)-Pyrimidinedione, dihydro-6-(acetyloxy)-5-methyl-5-nitro-?
The CAS number of 2,4(1H,3H)-Pyrimidinedione, dihydro-6-(acetyloxy)-5-methyl-5-nitro- is 82531-52-0.
What is the molecular formula of 2,4(1H,3H)-Pyrimidinedione, dihydro-6-(acetyloxy)-5-methyl-5-nitro-?
The molecular formula of 2,4(1H,3H)-Pyrimidinedione, dihydro-6-(acetyloxy)-5-methyl-5-nitro- is C7H9N3O6.
What is the molecular weight of 2,4(1H,3H)-Pyrimidinedione, dihydro-6-(acetyloxy)-5-methyl-5-nitro-?
The molecular weight of 2,4(1H,3H)-Pyrimidinedione, dihydro-6-(acetyloxy)-5-methyl-5-nitro- is 231.05 g/mol.
Where can I buy 2,4(1H,3H)-Pyrimidinedione, dihydro-6-(acetyloxy)-5-methyl-5-nitro-?
You can request a quote for 2,4(1H,3H)-Pyrimidinedione, dihydro-6-(acetyloxy)-5-methyl-5-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4(1H,3H)-Pyrimidinedione, dihydro-6-(acetyloxy)-5-methyl-5-nitro-?
Yes, KEHONG BIO provides custom synthesis services for 2,4(1H,3H)-Pyrimidinedione, dihydro-6-(acetyloxy)-5-methyl-5-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.