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N-Phenyl-N'-[2-(pyrrolidin-1-yl)ethyl]thiourea
TL;DR: N-Phenyl-N'-[2-(pyrrolidin-1-yl)ethyl]thiourea (CAS 57723-01-0) is a chemical compound with molecular formula C13H19N3S and molecular weight 249.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-3-(2-pyrrolidin-1-ylethyl)thiourea
Also Known As: 1-phenyl-3-(2-pyrrolidin-1-ylethyl)thiourea, N-Phenyl-N'-[2-(pyrrolidin-1-yl)ethyl]thiourea
| Molecular Formula | C13H19N3S |
|---|---|
| Molecular Weight | 249.13 g/mol |
| LogP | 2.0688 |
| Topological Polar Surface Area | 27.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 249.12997 |
| Heavy Atoms | 17 |
| Complexity | 346.94202 |
Chemical Identifiers
| CAS Number | 57723-01-0 |
|---|---|
| SMILES | C1CCN(C1)CCNC(=S)NC2=CC=CC=C2 |
Product Overview
N-Phenyl-N'-[2-(pyrrolidin-1-yl)ethyl]thiourea (CAS 57723-01-0), with molecular formula C13H19N3S and molecular weight 249.13 g/mol. IUPAC: 1-phenyl-3-(2-pyrrolidin-1-ylethyl)thiourea.
Chemical Property Profile of N-Phenyl-N'-[2-(pyrrolidin-1-yl)ethyl]thiourea
Property Insights of N-Phenyl-N'-[2-(pyrrolidin-1-yl)ethyl]thiourea
The XLogP value of 2.0688 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Phenyl-N'-[2-(pyrrolidin-1-yl)ethyl]thiourea. With a topological polar surface area (TPSA) of 27.3 Ų, N-Phenyl-N'-[2-(pyrrolidin-1-yl)ethyl]thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Phenyl-N'-[2-(pyrrolidin-1-yl)ethyl]thiourea 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 N-Phenyl-N'-[2-(pyrrolidin-1-yl)ethyl]thiourea?
The CAS number of N-Phenyl-N'-[2-(pyrrolidin-1-yl)ethyl]thiourea is 57723-01-0.
What is the molecular formula of N-Phenyl-N'-[2-(pyrrolidin-1-yl)ethyl]thiourea?
The molecular formula of N-Phenyl-N'-[2-(pyrrolidin-1-yl)ethyl]thiourea is C13H19N3S.
What is the molecular weight of N-Phenyl-N'-[2-(pyrrolidin-1-yl)ethyl]thiourea?
The molecular weight of N-Phenyl-N'-[2-(pyrrolidin-1-yl)ethyl]thiourea is 249.13 g/mol.
Where can I buy N-Phenyl-N'-[2-(pyrrolidin-1-yl)ethyl]thiourea?
You can request a quote for N-Phenyl-N'-[2-(pyrrolidin-1-yl)ethyl]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Phenyl-N'-[2-(pyrrolidin-1-yl)ethyl]thiourea?
Yes, KEHONG BIO provides custom synthesis services for N-Phenyl-N'-[2-(pyrrolidin-1-yl)ethyl]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.