N-[(1-benzylpiperidin-4-yl)carbamothioyl]furan-2-carboxamide
TL;DR: N-[(1-benzylpiperidin-4-yl)carbamothioyl]furan-2-carboxamide (CAS 438033-41-1) is a chemical compound with molecular formula C18H21N3O2S and molecular weight 343.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(1-benzylpiperidin-4-yl)carbamothioyl]furan-2-carboxamide
Also Known As: N-[(1-benzylpiperidin-4-yl)carbamothioyl]furan-2-carboxamide, AB00006050-01, N-{[(1-benzyl-4-piperidinyl)amino]carbonothioyl}-2-furamide, AN-329/43448588, N-(1-benzyl-4-piperidinyl)-N'-(2-furoyl)thiourea
| Molecular Formula | C18H21N3O2S |
|---|---|
| Molecular Weight | 343.14 g/mol |
| LogP | 2.5485 |
| Topological Polar Surface Area | 57.51 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 343.13544 |
| Heavy Atoms | 24 |
| Complexity | 664.83704 |
Chemical Identifiers
| CAS Number | 438033-41-1 |
|---|---|
| SMILES | C1CN(CCC1NC(=S)NC(=O)C2=CC=CO2)CC3=CC=CC=C3 |
Product Overview
N-[(1-benzylpiperidin-4-yl)carbamothioyl]furan-2-carboxamide (CAS 438033-41-1), with molecular formula C18H21N3O2S and molecular weight 343.14 g/mol. IUPAC: N-[(1-benzylpiperidin-4-yl)carbamothioyl]furan-2-carboxamide.
Chemical Property Profile of N-[(1-benzylpiperidin-4-yl)carbamothioyl]furan-2-carboxamide
Property Insights of N-[(1-benzylpiperidin-4-yl)carbamothioyl]furan-2-carboxamide
The XLogP value of 2.5485 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(1-benzylpiperidin-4-yl)carbamothioyl]furan-2-carboxamide. With a topological polar surface area (TPSA) of 57.51 Ų, N-[(1-benzylpiperidin-4-yl)carbamothioyl]furan-2-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(1-benzylpiperidin-4-yl)carbamothioyl]furan-2-carboxamide has 2 hydrogen bond donor(s) and 4 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-[(1-benzylpiperidin-4-yl)carbamothioyl]furan-2-carboxamide?
The CAS number of N-[(1-benzylpiperidin-4-yl)carbamothioyl]furan-2-carboxamide is 438033-41-1.
What is the molecular formula of N-[(1-benzylpiperidin-4-yl)carbamothioyl]furan-2-carboxamide?
The molecular formula of N-[(1-benzylpiperidin-4-yl)carbamothioyl]furan-2-carboxamide is C18H21N3O2S.
What is the molecular weight of N-[(1-benzylpiperidin-4-yl)carbamothioyl]furan-2-carboxamide?
The molecular weight of N-[(1-benzylpiperidin-4-yl)carbamothioyl]furan-2-carboxamide is 343.14 g/mol.
Where can I buy N-[(1-benzylpiperidin-4-yl)carbamothioyl]furan-2-carboxamide?
You can request a quote for N-[(1-benzylpiperidin-4-yl)carbamothioyl]furan-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(1-benzylpiperidin-4-yl)carbamothioyl]furan-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(1-benzylpiperidin-4-yl)carbamothioyl]furan-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.