N-(tert-butyl)-4-methyltetrahydro-1(2H)-pyrazinecarbothioamide
TL;DR: N-(tert-butyl)-4-methyltetrahydro-1(2H)-pyrazinecarbothioamide (CAS 692287-99-3) is a chemical compound with molecular formula C10H21N3S and molecular weight 215.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-tert-butyl-4-methylpiperazine-1-carbothioamide
Also Known As: N-tert-butyl-4-methylpiperazine-1-carbothioamide, N-(tert-butyl)-4-methyltetrahydro-1(2H)-pyrazinecarbothioamide, 4-methyl-N-tert-butyl-piperazine-1-carbothioamide, 5T-0830, N-tert-butyl-4-methyl-piperazine-1-carbothioamide
| Molecular Formula | C10H21N3S |
|---|---|
| Molecular Weight | 215.15 g/mol |
| LogP | 0.9068 |
| Topological Polar Surface Area | 18.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 215.14561 |
| Heavy Atoms | 14 |
| Complexity | 201.90288 |
Chemical Identifiers
| CAS Number | 692287-99-3 |
|---|---|
| SMILES | CC(C)(C)NC(=S)N1CCN(CC1)C |
Product Overview
N-(tert-butyl)-4-methyltetrahydro-1(2H)-pyrazinecarbothioamide (CAS 692287-99-3), with molecular formula C10H21N3S and molecular weight 215.15 g/mol. IUPAC: N-tert-butyl-4-methylpiperazine-1-carbothioamide.
Chemical Property Profile of N-(tert-butyl)-4-methyltetrahydro-1(2H)-pyrazinecarbothioamide
Property Insights of N-(tert-butyl)-4-methyltetrahydro-1(2H)-pyrazinecarbothioamide
The XLogP value of 0.9068 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(tert-butyl)-4-methyltetrahydro-1(2H)-pyrazinecarbothioamide. With a topological polar surface area (TPSA) of 18.51 Ų, N-(tert-butyl)-4-methyltetrahydro-1(2H)-pyrazinecarbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(tert-butyl)-4-methyltetrahydro-1(2H)-pyrazinecarbothioamide has 1 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 N-(tert-butyl)-4-methyltetrahydro-1(2H)-pyrazinecarbothioamide?
The CAS number of N-(tert-butyl)-4-methyltetrahydro-1(2H)-pyrazinecarbothioamide is 692287-99-3.
What is the molecular formula of N-(tert-butyl)-4-methyltetrahydro-1(2H)-pyrazinecarbothioamide?
The molecular formula of N-(tert-butyl)-4-methyltetrahydro-1(2H)-pyrazinecarbothioamide is C10H21N3S.
What is the molecular weight of N-(tert-butyl)-4-methyltetrahydro-1(2H)-pyrazinecarbothioamide?
The molecular weight of N-(tert-butyl)-4-methyltetrahydro-1(2H)-pyrazinecarbothioamide is 215.15 g/mol.
Where can I buy N-(tert-butyl)-4-methyltetrahydro-1(2H)-pyrazinecarbothioamide?
You can request a quote for N-(tert-butyl)-4-methyltetrahydro-1(2H)-pyrazinecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(tert-butyl)-4-methyltetrahydro-1(2H)-pyrazinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-(tert-butyl)-4-methyltetrahydro-1(2H)-pyrazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.