5-Bromo-1-butyldihydropyrimidine-2,4(1h,3h)-dione
TL;DR: 5-Bromo-1-butyldihydropyrimidine-2,4(1h,3h)-dione (CAS 91129-84-9) is a chemical compound with molecular formula C8H13BrN2O2 and molecular weight 248.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-1-butyl-1,3-diazinane-2,4-dione
Also Known As: 5-bromo-1-butyldihydropyrimidine-2,4(1h,3h)-dione, 5-bromo-1-butyl-1,3-diazinane-2,4-dione
| Molecular Formula | C8H13BrN2O2 |
|---|---|
| Molecular Weight | 248.02 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 248.01604 |
| Heavy Atoms | 13 |
| Complexity | 220.0 |
Chemical Identifiers
| CAS Number | 91129-84-9 |
|---|---|
| SMILES | CCCCN1CC(C(=O)NC1=O)Br |
| InChIKey | ZFJCGVGFWCJVBW-UHFFFAOYSA-N |
Product Overview
5-Bromo-1-butyldihydropyrimidine-2,4(1h,3h)-dione (CAS 91129-84-9), with molecular formula C8H13BrN2O2 and molecular weight 248.02 g/mol. IUPAC: 5-bromo-1-butyl-1,3-diazinane-2,4-dione.
Chemical Property Profile of 5-Bromo-1-butyldihydropyrimidine-2,4(1h,3h)-dione
Property Insights of 5-Bromo-1-butyldihydropyrimidine-2,4(1h,3h)-dione
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Bromo-1-butyldihydropyrimidine-2,4(1h,3h)-dione. With a topological polar surface area (TPSA) of 49.4 Ų, 5-Bromo-1-butyldihydropyrimidine-2,4(1h,3h)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Bromo-1-butyldihydropyrimidine-2,4(1h,3h)-dione has 1 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 5-Bromo-1-butyldihydropyrimidine-2,4(1h,3h)-dione?
The CAS number of 5-Bromo-1-butyldihydropyrimidine-2,4(1h,3h)-dione is 91129-84-9.
What is the molecular formula of 5-Bromo-1-butyldihydropyrimidine-2,4(1h,3h)-dione?
The molecular formula of 5-Bromo-1-butyldihydropyrimidine-2,4(1h,3h)-dione is C8H13BrN2O2.
What is the molecular weight of 5-Bromo-1-butyldihydropyrimidine-2,4(1h,3h)-dione?
The molecular weight of 5-Bromo-1-butyldihydropyrimidine-2,4(1h,3h)-dione is 248.02 g/mol.
Where can I buy 5-Bromo-1-butyldihydropyrimidine-2,4(1h,3h)-dione?
You can request a quote for 5-Bromo-1-butyldihydropyrimidine-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 5-Bromo-1-butyldihydropyrimidine-2,4(1h,3h)-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromo-1-butyldihydropyrimidine-2,4(1h,3h)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.