4-Tert-butylcyclohexyl 4-oxo-4-(1,3-thiazol-2-ylamino)butanoate
TL;DR: 4-Tert-butylcyclohexyl 4-oxo-4-(1,3-thiazol-2-ylamino)butanoate (CAS 372970-35-9) is a chemical compound with molecular formula C17H26N2O3S and molecular weight 338.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-tert-butylcyclohexyl) 4-oxo-4-(1,3-thiazol-2-ylamino)butanoate
Also Known As: ChemDiv2_003776, IDI1_002491, 4-(tert-butyl)cyclohexyl 4-oxo-4-(thiazol-2-ylamino)butanoate, 4-tert-butylcyclohexyl 4-oxo-4-(1,3-thiazol-2-ylamino)butanoate, (4-tert-butylcyclohexyl) 4-oxo-4-(1,3-thiazol-2-ylamino)butanoate
| Molecular Formula | C17H26N2O3S |
|---|---|
| Molecular Weight | 338.17 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 96.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 338.1664 |
| Heavy Atoms | 23 |
| Complexity | 415.0 |
Chemical Identifiers
| CAS Number | 372970-35-9 |
|---|---|
| SMILES | CC(C)(C)C1CCC(CC1)OC(=O)CCC(=O)NC2=NC=CS2 |
| InChIKey | NQTGEEVPVHGAKJ-UHFFFAOYSA-N |
Product Overview
4-Tert-butylcyclohexyl 4-oxo-4-(1,3-thiazol-2-ylamino)butanoate (CAS 372970-35-9), with molecular formula C17H26N2O3S and molecular weight 338.17 g/mol. IUPAC: (4-tert-butylcyclohexyl) 4-oxo-4-(1,3-thiazol-2-ylamino)butanoate.
Chemical Property Profile of 4-Tert-butylcyclohexyl 4-oxo-4-(1,3-thiazol-2-ylamino)butanoate
Property Insights of 4-Tert-butylcyclohexyl 4-oxo-4-(1,3-thiazol-2-ylamino)butanoate
The XLogP value of 3.5 indicates that 4-Tert-butylcyclohexyl 4-oxo-4-(1,3-thiazol-2-ylamino)butanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Tert-butylcyclohexyl 4-oxo-4-(1,3-thiazol-2-ylamino)butanoate. Following Lipinski's Rule of Five, 4-Tert-butylcyclohexyl 4-oxo-4-(1,3-thiazol-2-ylamino)butanoate has 1 hydrogen bond donor(s) and 5 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 4-Tert-butylcyclohexyl 4-oxo-4-(1,3-thiazol-2-ylamino)butanoate?
The CAS number of 4-Tert-butylcyclohexyl 4-oxo-4-(1,3-thiazol-2-ylamino)butanoate is 372970-35-9.
What is the molecular formula of 4-Tert-butylcyclohexyl 4-oxo-4-(1,3-thiazol-2-ylamino)butanoate?
The molecular formula of 4-Tert-butylcyclohexyl 4-oxo-4-(1,3-thiazol-2-ylamino)butanoate is C17H26N2O3S.
What is the molecular weight of 4-Tert-butylcyclohexyl 4-oxo-4-(1,3-thiazol-2-ylamino)butanoate?
The molecular weight of 4-Tert-butylcyclohexyl 4-oxo-4-(1,3-thiazol-2-ylamino)butanoate is 338.17 g/mol.
Where can I buy 4-Tert-butylcyclohexyl 4-oxo-4-(1,3-thiazol-2-ylamino)butanoate?
You can request a quote for 4-Tert-butylcyclohexyl 4-oxo-4-(1,3-thiazol-2-ylamino)butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Tert-butylcyclohexyl 4-oxo-4-(1,3-thiazol-2-ylamino)butanoate?
Yes, KEHONG BIO provides custom synthesis services for 4-Tert-butylcyclohexyl 4-oxo-4-(1,3-thiazol-2-ylamino)butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.