![1-Tert-butyl-3-[2-(tert-butylcarbamothioylamino)ethyl]thiourea structure](/static/products/1305/13057-37-9.webp)
1-Tert-butyl-3-[2-(tert-butylcarbamothioylamino)ethyl]thiourea
TL;DR: 1-Tert-butyl-3-[2-(tert-butylcarbamothioylamino)ethyl]thiourea (CAS 13057-37-9) is a chemical compound with molecular formula C12H26N4S2 and molecular weight 290.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-tert-butyl-3-[2-(tert-butylcarbamothioylamino)ethyl]thiourea
Also Known As: 3,3 -Ethylenebis(1-tert-butylthiourea), J3.700.648C, 1-tert-butyl-3-[2-(tert-butylcarbamothioylamino)ethyl]thiourea, N,N'-Ethane-1,2-diylbis[N'-tert-butyl(thiourea)], 1-tert-butyl-3-[2-(tert-butylcarbamothioylamino)ethyl]thiour
| Molecular Formula | C12H26N4S2 |
|---|---|
| Molecular Weight | 290.16 g/mol |
| LogP | 1.5116 |
| Topological Polar Surface Area | 48.12 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 290.15988 |
| Heavy Atoms | 18 |
| Complexity | 259.43298 |
Chemical Identifiers
| CAS Number | 13057-37-9 |
|---|---|
| SMILES | CC(C)(C)NC(=S)NCCNC(=S)NC(C)(C)C |
Product Overview
1-Tert-butyl-3-[2-(tert-butylcarbamothioylamino)ethyl]thiourea (CAS 13057-37-9), with molecular formula C12H26N4S2 and molecular weight 290.16 g/mol. IUPAC: 1-tert-butyl-3-[2-(tert-butylcarbamothioylamino)ethyl]thiourea.
Chemical Property Profile of 1-Tert-butyl-3-[2-(tert-butylcarbamothioylamino)ethyl]thiourea
Property Insights of 1-Tert-butyl-3-[2-(tert-butylcarbamothioylamino)ethyl]thiourea
The XLogP value of 1.5116 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Tert-butyl-3-[2-(tert-butylcarbamothioylamino)ethyl]thiourea. With a topological polar surface area (TPSA) of 48.12 Ų, 1-Tert-butyl-3-[2-(tert-butylcarbamothioylamino)ethyl]thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Tert-butyl-3-[2-(tert-butylcarbamothioylamino)ethyl]thiourea has 4 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 1-Tert-butyl-3-[2-(tert-butylcarbamothioylamino)ethyl]thiourea?
The CAS number of 1-Tert-butyl-3-[2-(tert-butylcarbamothioylamino)ethyl]thiourea is 13057-37-9.
What is the molecular formula of 1-Tert-butyl-3-[2-(tert-butylcarbamothioylamino)ethyl]thiourea?
The molecular formula of 1-Tert-butyl-3-[2-(tert-butylcarbamothioylamino)ethyl]thiourea is C12H26N4S2.
What is the molecular weight of 1-Tert-butyl-3-[2-(tert-butylcarbamothioylamino)ethyl]thiourea?
The molecular weight of 1-Tert-butyl-3-[2-(tert-butylcarbamothioylamino)ethyl]thiourea is 290.16 g/mol.
Where can I buy 1-Tert-butyl-3-[2-(tert-butylcarbamothioylamino)ethyl]thiourea?
You can request a quote for 1-Tert-butyl-3-[2-(tert-butylcarbamothioylamino)ethyl]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Tert-butyl-3-[2-(tert-butylcarbamothioylamino)ethyl]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-Tert-butyl-3-[2-(tert-butylcarbamothioylamino)ethyl]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.