1-(1-Acetylpiperidin-4-yl)-3-ethyl-1-(4-fluorophenyl)thiourea
TL;DR: 1-(1-Acetylpiperidin-4-yl)-3-ethyl-1-(4-fluorophenyl)thiourea (CAS 893774-17-9) is a chemical compound with molecular formula C16H22FN3OS and molecular weight 323.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-acetylpiperidin-4-yl)-3-ethyl-1-(4-fluorophenyl)thiourea
Also Known As: 1-(1-acetylpiperidin-4-yl)-3-ethyl-1-(4-fluorophenyl)thiourea, A4103/0174964, N-(1-Acetyl-4-piperidinyl)-Na(2)-ethyl-N-(4-fluorophenyl)thiourea, N-(1-Acetylpiperidin-4-yl)-N'-ethyl-N-(4-fluorophenyl)thiourea
| Molecular Formula | C16H22FN3OS |
|---|---|
| Molecular Weight | 323.15 g/mol |
| LogP | 2.5374 |
| Topological Polar Surface Area | 35.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 323.14676 |
| Heavy Atoms | 22 |
| Complexity | 526.6974 |
Chemical Identifiers
| CAS Number | 893774-17-9 |
|---|---|
| SMILES | CCNC(=S)N(C1CCN(CC1)C(=O)C)C2=CC=C(C=C2)F |
Product Overview
1-(1-Acetylpiperidin-4-yl)-3-ethyl-1-(4-fluorophenyl)thiourea (CAS 893774-17-9), with molecular formula C16H22FN3OS and molecular weight 323.15 g/mol. IUPAC: 1-(1-acetylpiperidin-4-yl)-3-ethyl-1-(4-fluorophenyl)thiourea.
Chemical Property Profile of 1-(1-Acetylpiperidin-4-yl)-3-ethyl-1-(4-fluorophenyl)thiourea
Property Insights of 1-(1-Acetylpiperidin-4-yl)-3-ethyl-1-(4-fluorophenyl)thiourea
The XLogP value of 2.5374 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1-Acetylpiperidin-4-yl)-3-ethyl-1-(4-fluorophenyl)thiourea. With a topological polar surface area (TPSA) of 35.58 Ų, 1-(1-Acetylpiperidin-4-yl)-3-ethyl-1-(4-fluorophenyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1-Acetylpiperidin-4-yl)-3-ethyl-1-(4-fluorophenyl)thiourea has 1 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 1-(1-Acetylpiperidin-4-yl)-3-ethyl-1-(4-fluorophenyl)thiourea?
The CAS number of 1-(1-Acetylpiperidin-4-yl)-3-ethyl-1-(4-fluorophenyl)thiourea is 893774-17-9.
What is the molecular formula of 1-(1-Acetylpiperidin-4-yl)-3-ethyl-1-(4-fluorophenyl)thiourea?
The molecular formula of 1-(1-Acetylpiperidin-4-yl)-3-ethyl-1-(4-fluorophenyl)thiourea is C16H22FN3OS.
What is the molecular weight of 1-(1-Acetylpiperidin-4-yl)-3-ethyl-1-(4-fluorophenyl)thiourea?
The molecular weight of 1-(1-Acetylpiperidin-4-yl)-3-ethyl-1-(4-fluorophenyl)thiourea is 323.15 g/mol.
Where can I buy 1-(1-Acetylpiperidin-4-yl)-3-ethyl-1-(4-fluorophenyl)thiourea?
You can request a quote for 1-(1-Acetylpiperidin-4-yl)-3-ethyl-1-(4-fluorophenyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1-Acetylpiperidin-4-yl)-3-ethyl-1-(4-fluorophenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(1-Acetylpiperidin-4-yl)-3-ethyl-1-(4-fluorophenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.