1,3-Dibromo-5-methyl-1,3-diazinane-2,4-dione
TL;DR: 1,3-Dibromo-5-methyl-1,3-diazinane-2,4-dione (CAS 90389-19-8) is a chemical compound with molecular formula C5H6Br2N2O2 and molecular weight 283.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dibromo-5-methyl-1,3-diazinane-2,4-dione
Also Known As: KST-1B9134, 1,3-dibromo-5-methyl-1,3-diazinane-2,4-dione, 2-Pentanone,3-bromo-5,5,5-trinitro, 1,3-dibromo-5-methyldihydropyrimidine-2,4(1h,3h)-dione, 2,4(1H,3H)-Pyrimidinedione, 1,3-dibromodihydro-5-methyl-
| Molecular Formula | C5H6Br2N2O2 |
|---|---|
| Molecular Weight | 283.88 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 40.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 283.8796 |
| Heavy Atoms | 11 |
| Complexity | 209.0 |
Chemical Identifiers
| CAS Number | 90389-19-8 |
|---|---|
| SMILES | CC1CN(C(=O)N(C1=O)Br)Br |
| InChIKey | DPBNIEKFTIKTOA-UHFFFAOYSA-N |
Product Overview
1,3-Dibromo-5-methyl-1,3-diazinane-2,4-dione (CAS 90389-19-8), with molecular formula C5H6Br2N2O2 and molecular weight 283.88 g/mol. IUPAC: 1,3-dibromo-5-methyl-1,3-diazinane-2,4-dione.
Chemical Property Profile of 1,3-Dibromo-5-methyl-1,3-diazinane-2,4-dione
Property Insights of 1,3-Dibromo-5-methyl-1,3-diazinane-2,4-dione
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dibromo-5-methyl-1,3-diazinane-2,4-dione. With a topological polar surface area (TPSA) of 40.6 Ų, 1,3-Dibromo-5-methyl-1,3-diazinane-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dibromo-5-methyl-1,3-diazinane-2,4-dione has 0 hydrogen bond donor(s) and 2 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 1,3-Dibromo-5-methyl-1,3-diazinane-2,4-dione?
The CAS number of 1,3-Dibromo-5-methyl-1,3-diazinane-2,4-dione is 90389-19-8.
What is the molecular formula of 1,3-Dibromo-5-methyl-1,3-diazinane-2,4-dione?
The molecular formula of 1,3-Dibromo-5-methyl-1,3-diazinane-2,4-dione is C5H6Br2N2O2.
What is the molecular weight of 1,3-Dibromo-5-methyl-1,3-diazinane-2,4-dione?
The molecular weight of 1,3-Dibromo-5-methyl-1,3-diazinane-2,4-dione is 283.88 g/mol.
Where can I buy 1,3-Dibromo-5-methyl-1,3-diazinane-2,4-dione?
You can request a quote for 1,3-Dibromo-5-methyl-1,3-diazinane-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dibromo-5-methyl-1,3-diazinane-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dibromo-5-methyl-1,3-diazinane-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.