Uracil, 5-bromo-3-sec-butyl-6-methyl-2-thio-
TL;DR: Uracil, 5-bromo-3-sec-butyl-6-methyl-2-thio- (CAS 24561-91-9) is a chemical compound with molecular formula C9H13BrN2OS and molecular weight 275.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-3-butan-2-yl-6-methyl-2-sulfanylidene-1H-pyrimidin-4-one
Also Known As: Uracil, 5-bromo-3-sec-butyl-6-methyl-2-thio-, 5-Bromo-3-sec-butyl-6-methyl-1,2-dihydro-2-thioxopyrimidin-4 -one, 5-Bromo-3-sec-butyl-6-methyl-2-sulfanyl-4(3H)-pyrimidinone #, 5-bromo-3-butan-2-yl-6-methyl-2-sulfanylidene-1H-pyrimidin-4-one, 5-Bromo-3-sec-butyl-6-methyl-1,2-dihydro-2-thioxopyrimidin-4(3H)-one
| Molecular Formula | C9H13BrN2OS |
|---|---|
| Molecular Weight | 275.99 g/mol |
| LogP | 2.94781 |
| Topological Polar Surface Area | 37.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 275.9932 |
| Heavy Atoms | 14 |
| Complexity | 449.10568 |
Chemical Identifiers
| CAS Number | 24561-91-9 |
|---|---|
| SMILES | CCC(C)N1C(=O)C(=C(NC1=S)C)Br |
Product Overview
Uracil, 5-bromo-3-sec-butyl-6-methyl-2-thio- (CAS 24561-91-9), with molecular formula C9H13BrN2OS and molecular weight 275.99 g/mol. IUPAC: 5-bromo-3-butan-2-yl-6-methyl-2-sulfanylidene-1H-pyrimidin-4-one.
Chemical Property Profile of Uracil, 5-bromo-3-sec-butyl-6-methyl-2-thio-
Property Insights of Uracil, 5-bromo-3-sec-butyl-6-methyl-2-thio-
The XLogP value of 2.94781 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Uracil, 5-bromo-3-sec-butyl-6-methyl-2-thio-. With a topological polar surface area (TPSA) of 37.79 Ų, Uracil, 5-bromo-3-sec-butyl-6-methyl-2-thio- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Uracil, 5-bromo-3-sec-butyl-6-methyl-2-thio- 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 Uracil, 5-bromo-3-sec-butyl-6-methyl-2-thio-?
The CAS number of Uracil, 5-bromo-3-sec-butyl-6-methyl-2-thio- is 24561-91-9.
What is the molecular formula of Uracil, 5-bromo-3-sec-butyl-6-methyl-2-thio-?
The molecular formula of Uracil, 5-bromo-3-sec-butyl-6-methyl-2-thio- is C9H13BrN2OS.
What is the molecular weight of Uracil, 5-bromo-3-sec-butyl-6-methyl-2-thio-?
The molecular weight of Uracil, 5-bromo-3-sec-butyl-6-methyl-2-thio- is 275.99 g/mol.
Where can I buy Uracil, 5-bromo-3-sec-butyl-6-methyl-2-thio-?
You can request a quote for Uracil, 5-bromo-3-sec-butyl-6-methyl-2-thio- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Uracil, 5-bromo-3-sec-butyl-6-methyl-2-thio-?
Yes, KEHONG BIO provides custom synthesis services for Uracil, 5-bromo-3-sec-butyl-6-methyl-2-thio- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.