3-(二乙氨基)-1-丙硫醇
TL;DR: 3-(二乙氨基)-1-丙硫醇 (CAS 55790-39-1) is a chemical compound with molecular formula C7H17NS and molecular weight 147.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(二乙氨基)-1-丙硫醇
3-(diethylamino)propane-1-thiol
Also Known As: 3-Diethylaminopropanethiol, 1-Propanethiol, 3-(diethylamino)-, 3-(diethylamino)propane-1-thiol, N-Diaethylhomocysteamin, 3- -1-propanethiol
| Molecular Formula | C7H17NS |
|---|---|
| Molecular Weight | 147.11 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 4.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 147.10817 |
| Heavy Atoms | 9 |
| Complexity | 52.0 |
Chemical Identifiers
| CAS Number | 55790-39-1 |
|---|---|
| SMILES | CCN(CC)CCCS |
| InChIKey | XQFQYOHHVAEHPL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(二乙氨基)-1-丙硫醇 (CAS 55790-39-1), with molecular formula C7H17NS and molecular weight 147.11 g/mol. IUPAC: 3-(diethylamino)propane-1-thiol.
Chemical Property Profile of 3-(二乙氨基)-1-丙硫醇
Property Insights of 3-(二乙氨基)-1-丙硫醇
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(二乙氨基)-1-丙硫醇. With a topological polar surface area (TPSA) of 4.2 Ų, 3-(二乙氨基)-1-丙硫醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(二乙氨基)-1-丙硫醇 has 1 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-(二乙氨基)-1-丙硫醇?
The CAS number of 3-(二乙氨基)-1-丙硫醇 is 55790-39-1.
What is the molecular formula of 3-(二乙氨基)-1-丙硫醇?
The molecular formula of 3-(二乙氨基)-1-丙硫醇 is C7H17NS.
What is the molecular weight of 3-(二乙氨基)-1-丙硫醇?
The molecular weight of 3-(二乙氨基)-1-丙硫醇 is 147.11 g/mol.
Where can I buy 3-(二乙氨基)-1-丙硫醇?
You can request a quote for 3-(二乙氨基)-1-丙硫醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(二乙氨基)-1-丙硫醇?
Yes, KEHONG BIO provides custom synthesis services for 3-(二乙氨基)-1-丙硫醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.