![N-(tert-butyl)-2-[imino(methylamino)methylthio]acetamide structure](/static/products/4474/447412-45-5.webp)
N-(tert-butyl)-2-[imino(methylamino)methylthio]acetamide
TL;DR: N-(tert-butyl)-2-[imino(methylamino)methylthio]acetamide (CAS 447412-45-5) is a chemical compound with molecular formula C8H17N3OS and molecular weight 203.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(tert-butylamino)-2-oxoethyl] N'-methylcarbamimidothioate
Also Known As: [2-(tert-butylamino)-2-oxoethyl] N'-methylcarbamimidothioate|N-(tert-butyl)-2-[imino(methylamino)methylthio]acetamide|N-TERT-BUTYL-2-[(N-METHYLCARBAMIMIDOYL)SULFANYL]ACETAMIDE|2-(tert-butylamino)-2-oxoethyl N-methylcarbamimidothioate|2-(tert-butylamino)-2-oxoethyl N-methylimidothiocarbamate hydrochloride|A2642/0112504|carbamimidothioic acid, N-methyl-, 2-[(1,1-dimethylethyl)amino]-2-oxoethyl ester, hydrochloride|ALBB-023129
| Molecular Formula | C8H17N3OS |
|---|---|
| Molecular Weight | 203.11 g/mol |
| LogP | 0.5788 |
| Topological Polar Surface Area | 67.48 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 203.10924 |
| Heavy Atoms | 13 |
| Complexity | 207.9249 |
Chemical Identifiers
| CAS Number | 447412-45-5 |
|---|---|
| SMILES | CC(C)(C)NC(=O)CSC(=NC)N |
Product Overview
N-(tert-butyl)-2-[imino(methylamino)methylthio]acetamide (CAS 447412-45-5), with molecular formula C8H17N3OS and molecular weight 203.11 g/mol. IUPAC: [2-(tert-butylamino)-2-oxoethyl] N'-methylcarbamimidothioate.
Chemical Property Profile of N-(tert-butyl)-2-[imino(methylamino)methylthio]acetamide
Property Insights of N-(tert-butyl)-2-[imino(methylamino)methylthio]acetamide
The XLogP value of 0.5788 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(tert-butyl)-2-[imino(methylamino)methylthio]acetamide. The TPSA of 67.48 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(tert-butyl)-2-[imino(methylamino)methylthio]acetamide. Following Lipinski's Rule of Five, N-(tert-butyl)-2-[imino(methylamino)methylthio]acetamide has 2 hydrogen bond donor(s) and 3 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)-2-[imino(methylamino)methylthio]acetamide?
The CAS number of N-(tert-butyl)-2-[imino(methylamino)methylthio]acetamide is 447412-45-5.
What is the molecular formula of N-(tert-butyl)-2-[imino(methylamino)methylthio]acetamide?
The molecular formula of N-(tert-butyl)-2-[imino(methylamino)methylthio]acetamide is C8H17N3OS.
What is the molecular weight of N-(tert-butyl)-2-[imino(methylamino)methylthio]acetamide?
The molecular weight of N-(tert-butyl)-2-[imino(methylamino)methylthio]acetamide is 203.11 g/mol.
Where can I buy N-(tert-butyl)-2-[imino(methylamino)methylthio]acetamide?
You can request a quote for N-(tert-butyl)-2-[imino(methylamino)methylthio]acetamide 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)-2-[imino(methylamino)methylthio]acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(tert-butyl)-2-[imino(methylamino)methylthio]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.