(2-Ethyl-butanoyl)thiourea
TL;DR: (2-Ethyl-butanoyl)thiourea (CAS 17464-80-1) is a chemical compound with molecular formula C7H14N2OS and molecular weight 174.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-carbamothioyl-2-ethylbutanamide
Also Known As: (2-Ethyl-butanoyl)thiourea, N-carbamothioyl-2-ethylbutanamide, N-(2-Ethylbutanoyl)thiourea #, Butanamide,N-(aminothioxomethyl)-2-ethyl-, RefChem:205999
| Molecular Formula | C7H14N2OS |
|---|---|
| Molecular Weight | 174.08 g/mol |
| LogP | 0.7824 |
| Topological Polar Surface Area | 55.12 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 174.08269 |
| Heavy Atoms | 11 |
| Complexity | 154.51956 |
Chemical Identifiers
| CAS Number | 17464-80-1 |
|---|---|
| SMILES | CCC(CC)C(=O)NC(=S)N |
Product Overview
(2-Ethyl-butanoyl)thiourea (CAS 17464-80-1), with molecular formula C7H14N2OS and molecular weight 174.08 g/mol. IUPAC: N-carbamothioyl-2-ethylbutanamide.
Chemical Property Profile of (2-Ethyl-butanoyl)thiourea
Property Insights of (2-Ethyl-butanoyl)thiourea
The XLogP value of 0.7824 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-Ethyl-butanoyl)thiourea. With a topological polar surface area (TPSA) of 55.12 Ų, (2-Ethyl-butanoyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-Ethyl-butanoyl)thiourea has 2 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 (2-Ethyl-butanoyl)thiourea?
The CAS number of (2-Ethyl-butanoyl)thiourea is 17464-80-1.
What is the molecular formula of (2-Ethyl-butanoyl)thiourea?
The molecular formula of (2-Ethyl-butanoyl)thiourea is C7H14N2OS.
What is the molecular weight of (2-Ethyl-butanoyl)thiourea?
The molecular weight of (2-Ethyl-butanoyl)thiourea is 174.08 g/mol.
Where can I buy (2-Ethyl-butanoyl)thiourea?
You can request a quote for (2-Ethyl-butanoyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Ethyl-butanoyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for (2-Ethyl-butanoyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.