3-Amino-2-butanethiol
TL;DR: 3-Amino-2-butanethiol (CAS 4146-17-2) is a chemical compound with molecular formula C4H11NS and molecular weight 105.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-aminobutane-2-thiol
Also Known As: 3-aminobutane-2-thiol, 3-Amino-2-butanethiol, 3-amino-butane-2-thiol, 3-mercapto-2-butylamine, RefChem:276355
| Molecular Formula | C4H11NS |
|---|---|
| Molecular Weight | 105.06 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 27.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 105.06122 |
| Heavy Atoms | 6 |
| Complexity | 38.0 |
Chemical Identifiers
| CAS Number | 4146-17-2 |
|---|---|
| SMILES | CC(C(C)S)N |
| InChIKey | XNMFUOBRLLJWJV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Amino-2-butanethiol (CAS 4146-17-2), with molecular formula C4H11NS and molecular weight 105.06 g/mol. IUPAC: 3-aminobutane-2-thiol.
Chemical Property Profile of 3-Amino-2-butanethiol
Property Insights of 3-Amino-2-butanethiol
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Amino-2-butanethiol. With a topological polar surface area (TPSA) of 27.0 Ų, 3-Amino-2-butanethiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Amino-2-butanethiol 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-2-butanethiol?
The CAS number of 3-Amino-2-butanethiol is 4146-17-2.
What is the molecular formula of 3-Amino-2-butanethiol?
The molecular formula of 3-Amino-2-butanethiol is C4H11NS.
What is the molecular weight of 3-Amino-2-butanethiol?
The molecular weight of 3-Amino-2-butanethiol is 105.06 g/mol.
Where can I buy 3-Amino-2-butanethiol?
You can request a quote for 3-Amino-2-butanethiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Amino-2-butanethiol?
Yes, KEHONG BIO provides custom synthesis services for 3-Amino-2-butanethiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.