3-(Diethylamino)propyl carbamimidothioate
TL;DR: 3-(Diethylamino)propyl carbamimidothioate (CAS 63680-36-4) is a chemical compound with molecular formula C8H19N3S and molecular weight 189.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(diethylamino)propyl carbamimidothioate
Also Known As: 3-(diethylamino)propylthiourea, 3-(diethylamino)propyl carbamimidothioate, 3-diethylaminopropylsulfanylmethanimidamide
| Molecular Formula | C8H19N3S |
|---|---|
| Molecular Weight | 189.13 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 78.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 189.12997 |
| Heavy Atoms | 12 |
| Complexity | 123.0 |
Chemical Identifiers
| CAS Number | 63680-36-4 |
|---|---|
| SMILES | CCN(CC)CCCSC(=N)N |
| InChIKey | QMJNGUGGOZECTA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(Diethylamino)propyl carbamimidothioate (CAS 63680-36-4), with molecular formula C8H19N3S and molecular weight 189.13 g/mol. IUPAC: 3-(diethylamino)propyl carbamimidothioate.
Chemical Property Profile of 3-(Diethylamino)propyl carbamimidothioate
Property Insights of 3-(Diethylamino)propyl carbamimidothioate
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Diethylamino)propyl carbamimidothioate. The TPSA of 78.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Diethylamino)propyl carbamimidothioate. Following Lipinski's Rule of Five, 3-(Diethylamino)propyl carbamimidothioate has 2 hydrogen bond donor(s) and 3 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-(Diethylamino)propyl carbamimidothioate?
The CAS number of 3-(Diethylamino)propyl carbamimidothioate is 63680-36-4.
What is the molecular formula of 3-(Diethylamino)propyl carbamimidothioate?
The molecular formula of 3-(Diethylamino)propyl carbamimidothioate is C8H19N3S.
What is the molecular weight of 3-(Diethylamino)propyl carbamimidothioate?
The molecular weight of 3-(Diethylamino)propyl carbamimidothioate is 189.13 g/mol.
Where can I buy 3-(Diethylamino)propyl carbamimidothioate?
You can request a quote for 3-(Diethylamino)propyl carbamimidothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Diethylamino)propyl carbamimidothioate?
Yes, KEHONG BIO provides custom synthesis services for 3-(Diethylamino)propyl carbamimidothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.