6-(Bromomethyl)-1,3-dimethyl-5-nitropyrimidine-2,4(1H,3H)-dione
TL;DR: 6-(Bromomethyl)-1,3-dimethyl-5-nitropyrimidine-2,4(1H,3H)-dione (CAS 472979-85-4) is a chemical compound with molecular formula C7H8BrN3O4 and molecular weight 276.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(bromomethyl)-1,3-dimethyl-5-nitropyrimidine-2,4-dione
Also Known As: 6-(Bromomethyl)-1,3-dimethyl-5-nitropyrimidine-2,4(1H,3H)-dione, 6-bromomethyl-1,3-dimethyl-5-nitrouracil, 6-(bromomethyl)-1,3-dimethyl-5-nitropyrimidine-2,4-dione, AE-848/34078006, 6-(bromomethyl)-5-nitro-1,3-dimethyl-2,4(1H,3H)-pyrimidinedione
| Molecular Formula | C7H8BrN3O4 |
|---|---|
| Molecular Weight | 276.97 g/mol |
| LogP | -0.1129 |
| Topological Polar Surface Area | 87.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 276.96982 |
| Heavy Atoms | 15 |
| Complexity | 530.26245 |
Chemical Identifiers
| CAS Number | 472979-85-4 |
|---|---|
| SMILES | CN1C(=C(C(=O)N(C1=O)C)[N+](=O)[O-])CBr |
Product Overview
6-(Bromomethyl)-1,3-dimethyl-5-nitropyrimidine-2,4(1H,3H)-dione (CAS 472979-85-4), with molecular formula C7H8BrN3O4 and molecular weight 276.97 g/mol. IUPAC: 6-(bromomethyl)-1,3-dimethyl-5-nitropyrimidine-2,4-dione.
Chemical Property Profile of 6-(Bromomethyl)-1,3-dimethyl-5-nitropyrimidine-2,4(1H,3H)-dione
Property Insights of 6-(Bromomethyl)-1,3-dimethyl-5-nitropyrimidine-2,4(1H,3H)-dione
The XLogP value of -0.1129 indicates that 6-(Bromomethyl)-1,3-dimethyl-5-nitropyrimidine-2,4(1H,3H)-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 87.14 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(Bromomethyl)-1,3-dimethyl-5-nitropyrimidine-2,4(1H,3H)-dione. Following Lipinski's Rule of Five, 6-(Bromomethyl)-1,3-dimethyl-5-nitropyrimidine-2,4(1H,3H)-dione has 0 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 6-(Bromomethyl)-1,3-dimethyl-5-nitropyrimidine-2,4(1H,3H)-dione?
The CAS number of 6-(Bromomethyl)-1,3-dimethyl-5-nitropyrimidine-2,4(1H,3H)-dione is 472979-85-4.
What is the molecular formula of 6-(Bromomethyl)-1,3-dimethyl-5-nitropyrimidine-2,4(1H,3H)-dione?
The molecular formula of 6-(Bromomethyl)-1,3-dimethyl-5-nitropyrimidine-2,4(1H,3H)-dione is C7H8BrN3O4.
What is the molecular weight of 6-(Bromomethyl)-1,3-dimethyl-5-nitropyrimidine-2,4(1H,3H)-dione?
The molecular weight of 6-(Bromomethyl)-1,3-dimethyl-5-nitropyrimidine-2,4(1H,3H)-dione is 276.97 g/mol.
Where can I buy 6-(Bromomethyl)-1,3-dimethyl-5-nitropyrimidine-2,4(1H,3H)-dione?
You can request a quote for 6-(Bromomethyl)-1,3-dimethyl-5-nitropyrimidine-2,4(1H,3H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(Bromomethyl)-1,3-dimethyl-5-nitropyrimidine-2,4(1H,3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-(Bromomethyl)-1,3-dimethyl-5-nitropyrimidine-2,4(1H,3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.