Pseudourea, 2-(3-phenylpropyl)-2-thio-, hydrochloride
TL;DR: Pseudourea, 2-(3-phenylpropyl)-2-thio-, hydrochloride (CAS 15260-25-0) is a chemical compound with molecular formula C10H15ClN2S and molecular weight 230.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenylpropyl carbamimidothioate;hydrochloride
Also Known As: 2-(3-Phenylpropyl)-2-thiopseudourea hydrochloride, Pseudourea, 2-(3-phenylpropyl)-2-thio-, hydrochloride, S-(3-phenyl-propyl)-isothiourea; hydrochloride, 3-phenylpropyl carbamimidothioate hydrochloride, 3-Phenylpropyl carbamimidothioate--hydrogen chloride (1/1)
| Molecular Formula | C10H15ClN2S |
|---|---|
| Molecular Weight | 230.06 g/mol |
| LogP | 2.66767 |
| Topological Polar Surface Area | 75.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 230.06445 |
| Heavy Atoms | 14 |
| Complexity | 153.0 |
Chemical Identifiers
| CAS Number | 15260-25-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCCSC(=N)N.Cl |
| InChIKey | ZLDBQPKSWUVXQP-UHFFFAOYSA-N |
Product Overview
Pseudourea, 2-(3-phenylpropyl)-2-thio-, hydrochloride (CAS 15260-25-0), with molecular formula C10H15ClN2S and molecular weight 230.06 g/mol. IUPAC: 3-phenylpropyl carbamimidothioate;hydrochloride.
Chemical Property Profile of Pseudourea, 2-(3-phenylpropyl)-2-thio-, hydrochloride
Property Insights of Pseudourea, 2-(3-phenylpropyl)-2-thio-, hydrochloride
The XLogP value of 2.66767 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pseudourea, 2-(3-phenylpropyl)-2-thio-, hydrochloride. The TPSA of 75.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Pseudourea, 2-(3-phenylpropyl)-2-thio-, hydrochloride. Following Lipinski's Rule of Five, Pseudourea, 2-(3-phenylpropyl)-2-thio-, hydrochloride has 3 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 Pseudourea, 2-(3-phenylpropyl)-2-thio-, hydrochloride?
The CAS number of Pseudourea, 2-(3-phenylpropyl)-2-thio-, hydrochloride is 15260-25-0.
What is the molecular formula of Pseudourea, 2-(3-phenylpropyl)-2-thio-, hydrochloride?
The molecular formula of Pseudourea, 2-(3-phenylpropyl)-2-thio-, hydrochloride is C10H15ClN2S.
What is the molecular weight of Pseudourea, 2-(3-phenylpropyl)-2-thio-, hydrochloride?
The molecular weight of Pseudourea, 2-(3-phenylpropyl)-2-thio-, hydrochloride is 230.06 g/mol.
Where can I buy Pseudourea, 2-(3-phenylpropyl)-2-thio-, hydrochloride?
You can request a quote for Pseudourea, 2-(3-phenylpropyl)-2-thio-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pseudourea, 2-(3-phenylpropyl)-2-thio-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Pseudourea, 2-(3-phenylpropyl)-2-thio-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.