1-Butanone, 4-piperidino-1-(2-thiazolyl)-, hydrobromide
TL;DR: 1-Butanone, 4-piperidino-1-(2-thiazolyl)-, hydrobromide (CAS 38291-72-4) is a chemical compound with molecular formula C12H19BrN2OS and molecular weight 318.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-piperidin-1-yl-1-(1,3-thiazol-2-yl)butan-1-one;hydrobromide
Also Known As: 1-Butanone, 4-piperidino-1-(2-thiazolyl)-, hydrobromide, 4-Piperidino-1-(2-thiazolyl)-1-butanone hydrobromide, (Thiazolyl-2)(3-N-piperidinopropyl)ketone hydrobromide, 4-(piperidin-1-yl)-1-(1,3-thiazol-2-yl)butan-1-one hydrobromide(1:1), 4-piperidin-1-yl-1-(1,3-thiazol-2-yl)butan-1-one hydrobromide
| Molecular Formula | C12H19BrN2OS |
|---|---|
| Molecular Weight | 318.04 g/mol |
| LogP | 3.1698 |
| Topological Polar Surface Area | 61.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 318.04016 |
| Heavy Atoms | 17 |
| Complexity | 229.0 |
Chemical Identifiers
| CAS Number | 38291-72-4 |
|---|---|
| SMILES | C1CCN(CC1)CCCC(=O)C2=NC=CS2.Br |
| InChIKey | ZYHJPJXLKFVHGJ-UHFFFAOYSA-N |
Product Overview
1-Butanone, 4-piperidino-1-(2-thiazolyl)-, hydrobromide (CAS 38291-72-4), with molecular formula C12H19BrN2OS and molecular weight 318.04 g/mol. IUPAC: 4-piperidin-1-yl-1-(1,3-thiazol-2-yl)butan-1-one;hydrobromide.
Chemical Property Profile of 1-Butanone, 4-piperidino-1-(2-thiazolyl)-, hydrobromide
Property Insights of 1-Butanone, 4-piperidino-1-(2-thiazolyl)-, hydrobromide
The XLogP value of 3.1698 indicates that 1-Butanone, 4-piperidino-1-(2-thiazolyl)-, hydrobromide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Butanone, 4-piperidino-1-(2-thiazolyl)-, hydrobromide. Following Lipinski's Rule of Five, 1-Butanone, 4-piperidino-1-(2-thiazolyl)-, hydrobromide has 1 hydrogen bond donor(s) and 4 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-Butanone, 4-piperidino-1-(2-thiazolyl)-, hydrobromide?
The CAS number of 1-Butanone, 4-piperidino-1-(2-thiazolyl)-, hydrobromide is 38291-72-4.
What is the molecular formula of 1-Butanone, 4-piperidino-1-(2-thiazolyl)-, hydrobromide?
The molecular formula of 1-Butanone, 4-piperidino-1-(2-thiazolyl)-, hydrobromide is C12H19BrN2OS.
What is the molecular weight of 1-Butanone, 4-piperidino-1-(2-thiazolyl)-, hydrobromide?
The molecular weight of 1-Butanone, 4-piperidino-1-(2-thiazolyl)-, hydrobromide is 318.04 g/mol.
Where can I buy 1-Butanone, 4-piperidino-1-(2-thiazolyl)-, hydrobromide?
You can request a quote for 1-Butanone, 4-piperidino-1-(2-thiazolyl)-, hydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Butanone, 4-piperidino-1-(2-thiazolyl)-, hydrobromide?
Yes, KEHONG BIO provides custom synthesis services for 1-Butanone, 4-piperidino-1-(2-thiazolyl)-, hydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.