RefChem:333495
TL;DR: RefChem:333495 (CAS 51308-69-1) is a chemical compound with molecular formula C22H30N2OS and molecular weight 370.2079 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
S-[(4-tert-butylphenyl)methyl] N-[2-(3-methylbutan-2-yl)-3-pyridinyl]carbamothioate
Also Known As: S-[(4-tert-butylphenyl)methyl] N-[2-(3-methylbutan-2-yl)pyridin-3-yl]carbamothioate, Carbonimidothioic acid, 3-pyridinyl-, S-((4-(1,1-dimethylethyl)phenyl)methyl)O-(1,2-dimethylpropyl) ester, N-[2-(3-methylbutan-2-yl)pyridin-3-yl]-1-[(4-tert-butylphenyl)methylsulfanyl]formamide, S-[(4-tert-Butylphenyl)methyl] hydrogen [2-(3-methylbutan-2-yl)pyridin-3-yl]carbonimidothioate
Technical Specifications
| Molecular Formula | C22H30N2OS |
| Molecular Weight | 370.2079 g/mol |
| XLogP | 6.1 |
| Topological Polar Surface Area (TPSA) | 67.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 370.2079 Da |
| Heavy Atoms | 26 |
| Complexity | 438.0 |
| SMILES | CC(C)C(C)C1=C(C=CC=N1)NC(=O)SCC2=CC=C(C=C2)C(C)(C)C |
| InChIKey | NKUJBMWSEPQKLQ-UHFFFAOYSA-N |
Product Description
Applications: RefChem:333495 is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies RefChem:333495 (CAS 51308-69-1) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
RefChem:333495 is a fine chemical identified by CAS number 51308-69-1 and the molecular formula C22H30N2OS and a molecular weight of 370.21 g/mol. It is also known as S-[(4-tert-butylphenyl)methyl] N-[2-(3-methylbutan-2-yl)pyridin-3-yl]carbamothioate and Carbonimidothioic acid, 3-pyridinyl-, S-((4-(1,1-dimethylethyl)phenyl)methyl)O-(1,2-dimethylpropyl) ester.
CoreyChem provides it with COA documentation, and custom synthesis from milligram to multi-kilogram scales is available on request. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of RefChem:333495
Property Insights of RefChem:333495
The XLogP value of 6.1 indicates that RefChem:333495 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.3 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:333495. Following Lipinski's Rule of Five, RefChem:333495 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:333495?
The CAS number of RefChem:333495 is 51308-69-1.
What is the molecular formula of RefChem:333495?
The molecular formula of RefChem:333495 is C22H30N2OS.
What is the molecular weight of RefChem:333495?
The molecular weight of RefChem:333495 is 370.2079 g/mol.
What are the applications of RefChem:333495?
RefChem:333495 is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies RefChem:333495 (CAS 51308-69-1) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and...
Where can I buy RefChem:333495?
You can request a quote for RefChem:333495 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:333495?
Yes, CoreyChem provides custom synthesis services for RefChem:333495 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.