4-(1-ethylbenzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide
TL;DR: 4-(1-ethylbenzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide (CAS 604741-85-7) is a chemical compound with molecular formula C19H27N5OS and molecular weight 373.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1-ethylbenzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide
Also Known As: 4-(1-ethylbenzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide, 4-(1-ethylbenzoimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide, 1-PIPERAZINECARBOTHIOAMIDE, 4-(1-ETHYL-1H-BENZIMIDAZOL-2-YL)-N-[(TETRAHYDRO-2-FURANYL)METHYL]-, 1-Piperazinecarbothioamide, 4-(1-ethyl-1H-benzimidazol-2-yl)-N-[(tetrahydro-2-furanyl)methyl]- (9CI)
| Molecular Formula | C19H27N5OS |
|---|---|
| Molecular Weight | 373.19 g/mol |
| LogP | 2.2317 |
| Topological Polar Surface Area | 45.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 373.19363 |
| Heavy Atoms | 26 |
| Complexity | 762.3753 |
Chemical Identifiers
| CAS Number | 604741-85-7 |
|---|---|
| SMILES | CCN1C2=CC=CC=C2N=C1N3CCN(CC3)C(=S)NCC4CCCO4 |
Product Overview
4-(1-ethylbenzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide (CAS 604741-85-7), with molecular formula C19H27N5OS and molecular weight 373.19 g/mol. IUPAC: 4-(1-ethylbenzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide.
Chemical Property Profile of 4-(1-ethylbenzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide
Property Insights of 4-(1-ethylbenzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide
The XLogP value of 2.2317 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(1-ethylbenzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide. With a topological polar surface area (TPSA) of 45.56 Ų, 4-(1-ethylbenzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(1-ethylbenzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide has 1 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 4-(1-ethylbenzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide?
The CAS number of 4-(1-ethylbenzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide is 604741-85-7.
What is the molecular formula of 4-(1-ethylbenzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide?
The molecular formula of 4-(1-ethylbenzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide is C19H27N5OS.
What is the molecular weight of 4-(1-ethylbenzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide?
The molecular weight of 4-(1-ethylbenzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide is 373.19 g/mol.
Where can I buy 4-(1-ethylbenzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide?
You can request a quote for 4-(1-ethylbenzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(1-ethylbenzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(1-ethylbenzimidazol-2-yl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.