2-Isopropenylthiazole
TL;DR: 2-Isopropenylthiazole (CAS 13856-10-5) is a chemical compound with molecular formula C6H7NS and molecular weight 125.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-prop-1-en-2-yl-1,3-thiazole
Also Known As: 2-Isopropenylthiazole, 2-(Prop-1-en-2-yl)thiazole, 2-Isopropenyl-thiazol, 2-prop-1-en-2-yl-1,3-thiazole, 7-Bromo-4-fluorobenzofuran
| Molecular Formula | C6H7NS |
|---|---|
| Molecular Weight | 125.03 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 125.02992 |
| Heavy Atoms | 8 |
| Complexity | 101.0 |
Chemical Identifiers
| CAS Number | 13856-10-5 |
|---|---|
| SMILES | CC(=C)C1=NC=CS1 |
| InChIKey | UDPXHYZDXKTGLD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Isopropenylthiazole (CAS 13856-10-5), with molecular formula C6H7NS and molecular weight 125.03 g/mol. IUPAC: 2-prop-1-en-2-yl-1,3-thiazole.
Chemical Property Profile of 2-Isopropenylthiazole
Property Insights of 2-Isopropenylthiazole
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Isopropenylthiazole. With a topological polar surface area (TPSA) of 41.1 Ų, 2-Isopropenylthiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Isopropenylthiazole 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 2-Isopropenylthiazole?
The CAS number of 2-Isopropenylthiazole is 13856-10-5.
What is the molecular formula of 2-Isopropenylthiazole?
The molecular formula of 2-Isopropenylthiazole is C6H7NS.
What is the molecular weight of 2-Isopropenylthiazole?
The molecular weight of 2-Isopropenylthiazole is 125.03 g/mol.
Where can I buy 2-Isopropenylthiazole?
You can request a quote for 2-Isopropenylthiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Isopropenylthiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-Isopropenylthiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.