3-(1H-benzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperidine-1-carbothioamide
TL;DR: 3-(1H-benzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperidine-1-carbothioamide (CAS 606089-83-2) is a chemical compound with molecular formula C18H24N4OS and molecular weight 344.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1H-benzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperidine-1-carbothioamide
Also Known As: 3-(1H-benzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperidine-1-carbothioamide, 3-(1H-benzoimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperidine-1-carbothioamide, 1-PIPERIDINECARBOTHIOAMIDE, 3-(1H-BENZIMIDAZOL-2-YL)-N-[(TETRAHYDRO-2-FURANYL)METHYL]-, 1-Piperidinecarbothioamide, 3-(1H-benzimidazol-2-yl)-N-[(tetrahydro-2-furanyl)methyl]- (9CI)
| Molecular Formula | C18H24N4OS |
|---|---|
| Molecular Weight | 344.17 g/mol |
| LogP | 2.7958 |
| Topological Polar Surface Area | 53.18 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 344.16708 |
| Heavy Atoms | 24 |
| Complexity | 676.8616 |
Chemical Identifiers
| CAS Number | 606089-83-2 |
|---|---|
| SMILES | C1CC(CN(C1)C(=S)NCC2CCCO2)C3=NC4=CC=CC=C4N3 |
Product Overview
3-(1H-benzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperidine-1-carbothioamide (CAS 606089-83-2), with molecular formula C18H24N4OS and molecular weight 344.17 g/mol. IUPAC: 3-(1H-benzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperidine-1-carbothioamide.
Chemical Property Profile of 3-(1H-benzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperidine-1-carbothioamide
Property Insights of 3-(1H-benzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperidine-1-carbothioamide
The XLogP value of 2.7958 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1H-benzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperidine-1-carbothioamide. With a topological polar surface area (TPSA) of 53.18 Ų, 3-(1H-benzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperidine-1-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1H-benzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperidine-1-carbothioamide has 2 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-(1H-benzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperidine-1-carbothioamide?
The CAS number of 3-(1H-benzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperidine-1-carbothioamide is 606089-83-2.
What is the molecular formula of 3-(1H-benzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperidine-1-carbothioamide?
The molecular formula of 3-(1H-benzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperidine-1-carbothioamide is C18H24N4OS.
What is the molecular weight of 3-(1H-benzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperidine-1-carbothioamide?
The molecular weight of 3-(1H-benzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperidine-1-carbothioamide is 344.17 g/mol.
Where can I buy 3-(1H-benzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperidine-1-carbothioamide?
You can request a quote for 3-(1H-benzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperidine-1-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1H-benzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperidine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(1H-benzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperidine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.