3-Amino-1-butyl-3-methylthiourea
TL;DR: 3-Amino-1-butyl-3-methylthiourea (CAS 21198-52-7) is a chemical compound with molecular formula C6H15N3S and molecular weight 161.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-amino-3-butyl-1-methylthiourea
Also Known As: N-butyl-1-methylhydrazinecarbothioamide, 3-amino-1-butyl-3-methylthiourea, 1-amino-3-butyl-1-methylthiourea, Hydrazinecarbothioamide,N-butyl-1-methyl-, 15Beta-hyfroxy-17beta-estradiol
| Molecular Formula | C6H15N3S |
|---|---|
| Molecular Weight | 161.10 g/mol |
| LogP | 0.4665 |
| Topological Polar Surface Area | 41.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 161.09866 |
| Heavy Atoms | 10 |
| Complexity | 103.16605 |
Chemical Identifiers
| CAS Number | 21198-52-7 |
|---|---|
| SMILES | CCCCNC(=S)N(C)N |
Product Overview
3-Amino-1-butyl-3-methylthiourea (CAS 21198-52-7), with molecular formula C6H15N3S and molecular weight 161.10 g/mol. IUPAC: 1-amino-3-butyl-1-methylthiourea.
Chemical Property Profile of 3-Amino-1-butyl-3-methylthiourea
Property Insights of 3-Amino-1-butyl-3-methylthiourea
The XLogP value of 0.4665 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Amino-1-butyl-3-methylthiourea. With a topological polar surface area (TPSA) of 41.29 Ų, 3-Amino-1-butyl-3-methylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Amino-1-butyl-3-methylthiourea 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 3-Amino-1-butyl-3-methylthiourea?
The CAS number of 3-Amino-1-butyl-3-methylthiourea is 21198-52-7.
What is the molecular formula of 3-Amino-1-butyl-3-methylthiourea?
The molecular formula of 3-Amino-1-butyl-3-methylthiourea is C6H15N3S.
What is the molecular weight of 3-Amino-1-butyl-3-methylthiourea?
The molecular weight of 3-Amino-1-butyl-3-methylthiourea is 161.10 g/mol.
Where can I buy 3-Amino-1-butyl-3-methylthiourea?
You can request a quote for 3-Amino-1-butyl-3-methylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Amino-1-butyl-3-methylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 3-Amino-1-butyl-3-methylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.