2,4(1H,3H)-Pyrimidinedione, dihydro-5-methyl-5-nitro-
TL;DR: 2,4(1H,3H)-Pyrimidinedione, dihydro-5-methyl-5-nitro- (CAS 67383-66-8) is a chemical compound with molecular formula C5H7N3O4 and molecular weight 173.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-5-nitro-1,3-diazinane-2,4-dione
Also Known As: Hydroxynitrodihydrothymine, 4-Hydroxy-5-nitro-4,5-dihydrothymine, Thymine, 4,5-dihydro-4-hydroxy-5-nitro-, 5-methyl-5-nitro-1,3-diazinane-2,4-dione, 2,4(1H,3H)-Pyrimidinedione, dihydro-5-methyl-5-nitro-
| Molecular Formula | C5H7N3O4 |
|---|---|
| Molecular Weight | 173.04 g/mol |
| LogP | -1.1388 |
| Topological Polar Surface Area | 101.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 173.04366 |
| Heavy Atoms | 12 |
| Complexity | 263.41895 |
Chemical Identifiers
| CAS Number | 67383-66-8 |
|---|---|
| SMILES | CC1(CNC(=O)NC1=O)[N+](=O)[O-] |
Product Overview
2,4(1H,3H)-Pyrimidinedione, dihydro-5-methyl-5-nitro- (CAS 67383-66-8), with molecular formula C5H7N3O4 and molecular weight 173.04 g/mol. IUPAC: 5-methyl-5-nitro-1,3-diazinane-2,4-dione.
Chemical Property Profile of 2,4(1H,3H)-Pyrimidinedione, dihydro-5-methyl-5-nitro-
Property Insights of 2,4(1H,3H)-Pyrimidinedione, dihydro-5-methyl-5-nitro-
The XLogP value of -1.1388 indicates that 2,4(1H,3H)-Pyrimidinedione, dihydro-5-methyl-5-nitro- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 101.34 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4(1H,3H)-Pyrimidinedione, dihydro-5-methyl-5-nitro-. Following Lipinski's Rule of Five, 2,4(1H,3H)-Pyrimidinedione, dihydro-5-methyl-5-nitro- has 2 hydrogen bond donor(s) and 4 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-5-methyl-5-nitro-?
The CAS number of 2,4(1H,3H)-Pyrimidinedione, dihydro-5-methyl-5-nitro- is 67383-66-8.
What is the molecular formula of 2,4(1H,3H)-Pyrimidinedione, dihydro-5-methyl-5-nitro-?
The molecular formula of 2,4(1H,3H)-Pyrimidinedione, dihydro-5-methyl-5-nitro- is C5H7N3O4.
What is the molecular weight of 2,4(1H,3H)-Pyrimidinedione, dihydro-5-methyl-5-nitro-?
The molecular weight of 2,4(1H,3H)-Pyrimidinedione, dihydro-5-methyl-5-nitro- is 173.04 g/mol.
Where can I buy 2,4(1H,3H)-Pyrimidinedione, dihydro-5-methyl-5-nitro-?
You can request a quote for 2,4(1H,3H)-Pyrimidinedione, dihydro-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-5-methyl-5-nitro-?
Yes, KEHONG BIO provides custom synthesis services for 2,4(1H,3H)-Pyrimidinedione, dihydro-5-methyl-5-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.