5-bromo-2-ethynylpyrimidine
TL;DR: 5-bromo-2-ethynylpyrimidine (CAS 7250-02-4) is a chemical compound with molecular formula C8H15N3OS and molecular weight 201.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-morpholin-4-yl-3-prop-2-enylthiourea
Also Known As: 5-bromo-2-ethynylpyrimidine, 1-ALLYL-3-MORPHOLIN-4-YL-THIOUREA, 1-morpholin-4-yl-3-prop-2-enylthiourea, Thiourea,N-4-morpholinyl-N'-2-propen-1-yl-, 1-MORPHOLIN-4-YL-3-PROP-2-ENYL-THIOUREA
| Molecular Formula | C8H15N3OS |
|---|---|
| Molecular Weight | 201.09 g/mol |
| LogP | -0.1163 |
| Topological Polar Surface Area | 36.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 201.09358 |
| Heavy Atoms | 13 |
| Complexity | 180.22795 |
Chemical Identifiers
| CAS Number | 7250-02-4 |
|---|---|
| SMILES | C=CCNC(=S)NN1CCOCC1 |
Product Overview
5-bromo-2-ethynylpyrimidine (CAS 7250-02-4), with molecular formula C8H15N3OS and molecular weight 201.09 g/mol. IUPAC: 1-morpholin-4-yl-3-prop-2-enylthiourea.
Chemical Property Profile of 5-bromo-2-ethynylpyrimidine
Property Insights of 5-bromo-2-ethynylpyrimidine
The XLogP value of -0.1163 indicates that 5-bromo-2-ethynylpyrimidine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 36.53 Ų, 5-bromo-2-ethynylpyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-bromo-2-ethynylpyrimidine has 2 hydrogen bond donor(s) and 3 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-2-ethynylpyrimidine?
The CAS number of 5-bromo-2-ethynylpyrimidine is 7250-02-4.
What is the molecular formula of 5-bromo-2-ethynylpyrimidine?
The molecular formula of 5-bromo-2-ethynylpyrimidine is C8H15N3OS.
What is the molecular weight of 5-bromo-2-ethynylpyrimidine?
The molecular weight of 5-bromo-2-ethynylpyrimidine is 201.09 g/mol.
Where can I buy 5-bromo-2-ethynylpyrimidine?
You can request a quote for 5-bromo-2-ethynylpyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-bromo-2-ethynylpyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 5-bromo-2-ethynylpyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.