Pseudourea, 2-(2-(pyrrolidinyl)ethyl)-2-thio-, dihydrochloride
TL;DR: Pseudourea, 2-(2-(pyrrolidinyl)ethyl)-2-thio-, dihydrochloride (CAS 64039-19-6) is a chemical compound with molecular formula C7H17Cl2N3S and molecular weight 245.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-pyrrolidin-1-ylethyl carbamimidothioate;dihydrochloride
Also Known As: Pseudourea, 2-(2-(pyrrolidinyl)ethyl)thio-, dihydrochloride, Pseudourea, 2-(2-(pyrrolidinyl)ethyl)-2-thio-, dihydrochloride, 2-(pyrrolidin-1-yl)ethyl carbamimidothioate dihydrochloride, 2-(2-(1-Pyrrolidinyl)ethyl)-2-thiopseudourea dihydrochloride, 2-pyrrolidin-1-ylethyl carbamimidothioate dihydrochloride
| Molecular Formula | C7H17Cl2N3S |
|---|---|
| Molecular Weight | 245.05 g/mol |
| LogP | 1.55 |
| Topological Polar Surface Area | 78.4 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 245.05202 |
| Heavy Atoms | 13 |
| Complexity | 132.0 |
Chemical Identifiers
| CAS Number | 64039-19-6 |
|---|---|
| SMILES | C1CCN(C1)CCSC(=N)N.Cl.Cl |
| InChIKey | TXRJZHFDKWUJND-UHFFFAOYSA-N |
Product Overview
Pseudourea, 2-(2-(pyrrolidinyl)ethyl)-2-thio-, dihydrochloride (CAS 64039-19-6), with molecular formula C7H17Cl2N3S and molecular weight 245.05 g/mol. IUPAC: 2-pyrrolidin-1-ylethyl carbamimidothioate;dihydrochloride.
Chemical Property Profile of Pseudourea, 2-(2-(pyrrolidinyl)ethyl)-2-thio-, dihydrochloride
Property Insights of Pseudourea, 2-(2-(pyrrolidinyl)ethyl)-2-thio-, dihydrochloride
The XLogP value of 1.55 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pseudourea, 2-(2-(pyrrolidinyl)ethyl)-2-thio-, dihydrochloride. The TPSA of 78.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Pseudourea, 2-(2-(pyrrolidinyl)ethyl)-2-thio-, dihydrochloride. Following Lipinski's Rule of Five, Pseudourea, 2-(2-(pyrrolidinyl)ethyl)-2-thio-, dihydrochloride has 4 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 Pseudourea, 2-(2-(pyrrolidinyl)ethyl)-2-thio-, dihydrochloride?
The CAS number of Pseudourea, 2-(2-(pyrrolidinyl)ethyl)-2-thio-, dihydrochloride is 64039-19-6.
What is the molecular formula of Pseudourea, 2-(2-(pyrrolidinyl)ethyl)-2-thio-, dihydrochloride?
The molecular formula of Pseudourea, 2-(2-(pyrrolidinyl)ethyl)-2-thio-, dihydrochloride is C7H17Cl2N3S.
What is the molecular weight of Pseudourea, 2-(2-(pyrrolidinyl)ethyl)-2-thio-, dihydrochloride?
The molecular weight of Pseudourea, 2-(2-(pyrrolidinyl)ethyl)-2-thio-, dihydrochloride is 245.05 g/mol.
Where can I buy Pseudourea, 2-(2-(pyrrolidinyl)ethyl)-2-thio-, dihydrochloride?
You can request a quote for Pseudourea, 2-(2-(pyrrolidinyl)ethyl)-2-thio-, dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pseudourea, 2-(2-(pyrrolidinyl)ethyl)-2-thio-, dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Pseudourea, 2-(2-(pyrrolidinyl)ethyl)-2-thio-, dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.