3-Benzoyl-1-[2-(1-benzyl-piperidin-4-yl)-ethyl]-1-methyl-thiourea
TL;DR: 3-Benzoyl-1-[2-(1-benzyl-piperidin-4-yl)-ethyl]-1-methyl-thiourea (CAS 145232-58-2) is a chemical compound with molecular formula C23H29N3OS and molecular weight 395.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(1-benzylpiperidin-4-yl)ethyl-methylcarbamothioyl]benzamide
Also Known As: 1-[Benzoyl]-3-[2-(1-benzylpiperidin-4-yl)ethyl]-3-methylthiourea, 1-benzoyl-3-[2-(1-benzylpiperidin-4-yl)ethyl]-3-methylthiourea, 3-Benzoyl-1-[2-(1-benzyl-piperidin-4-yl)-ethyl]-1-methyl-thiourea, N-[2-(1-benzyl-4-piperidyl)ethyl-methyl-thiocarbamoyl]benzamide, N-{[2-(1-Benzylpiperidin-4-yl)ethyl](methyl)carbamothioyl}benzamide
| Molecular Formula | C23H29N3OS |
|---|---|
| Molecular Weight | 395.20 g/mol |
| LogP | 3.9354 |
| Topological Polar Surface Area | 35.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 395.20312 |
| Heavy Atoms | 28 |
| Complexity | 757.9316 |
Chemical Identifiers
| CAS Number | 145232-58-2 |
|---|---|
| SMILES | CN(CCC1CCN(CC1)CC2=CC=CC=C2)C(=S)NC(=O)C3=CC=CC=C3 |
Product Overview
3-Benzoyl-1-[2-(1-benzyl-piperidin-4-yl)-ethyl]-1-methyl-thiourea (CAS 145232-58-2), with molecular formula C23H29N3OS and molecular weight 395.20 g/mol. IUPAC: N-[2-(1-benzylpiperidin-4-yl)ethyl-methylcarbamothioyl]benzamide.
Chemical Property Profile of 3-Benzoyl-1-[2-(1-benzyl-piperidin-4-yl)-ethyl]-1-methyl-thiourea
Property Insights of 3-Benzoyl-1-[2-(1-benzyl-piperidin-4-yl)-ethyl]-1-methyl-thiourea
The XLogP value of 3.9354 indicates that 3-Benzoyl-1-[2-(1-benzyl-piperidin-4-yl)-ethyl]-1-methyl-thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.58 Ų, 3-Benzoyl-1-[2-(1-benzyl-piperidin-4-yl)-ethyl]-1-methyl-thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Benzoyl-1-[2-(1-benzyl-piperidin-4-yl)-ethyl]-1-methyl-thiourea has 1 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-Benzoyl-1-[2-(1-benzyl-piperidin-4-yl)-ethyl]-1-methyl-thiourea?
The CAS number of 3-Benzoyl-1-[2-(1-benzyl-piperidin-4-yl)-ethyl]-1-methyl-thiourea is 145232-58-2.
What is the molecular formula of 3-Benzoyl-1-[2-(1-benzyl-piperidin-4-yl)-ethyl]-1-methyl-thiourea?
The molecular formula of 3-Benzoyl-1-[2-(1-benzyl-piperidin-4-yl)-ethyl]-1-methyl-thiourea is C23H29N3OS.
What is the molecular weight of 3-Benzoyl-1-[2-(1-benzyl-piperidin-4-yl)-ethyl]-1-methyl-thiourea?
The molecular weight of 3-Benzoyl-1-[2-(1-benzyl-piperidin-4-yl)-ethyl]-1-methyl-thiourea is 395.20 g/mol.
Where can I buy 3-Benzoyl-1-[2-(1-benzyl-piperidin-4-yl)-ethyl]-1-methyl-thiourea?
You can request a quote for 3-Benzoyl-1-[2-(1-benzyl-piperidin-4-yl)-ethyl]-1-methyl-thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Benzoyl-1-[2-(1-benzyl-piperidin-4-yl)-ethyl]-1-methyl-thiourea?
Yes, KEHONG BIO provides custom synthesis services for 3-Benzoyl-1-[2-(1-benzyl-piperidin-4-yl)-ethyl]-1-methyl-thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.