![S-[(E)-N'-(propan-2-ylideneamino)carbamimidoyl] furan-2-carbothioate structure](/static/products/928/92800-62-9.png)
S-[(E)-N'-(propan-2-ylideneamino)carbamimidoyl] furan-2-carbothioate
TL;DR: S-[(E)-N'-(propan-2-ylideneamino)carbamimidoyl] furan-2-carbothioate (CAS 92800-62-9) is a chemical compound with molecular formula C9H11N3O2S and molecular weight 225.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-[(E)-N'-(propan-2-ylideneamino)carbamimidoyl] furan-2-carbothioate
Also Known As: Furan-2-carbonyl N'-(propan-2-ylidene)carbamohydrazonothioate, S-[(E)-N'-(propan-2-ylideneamino)carbamimidoyl] furan-2-carb, S-[(E)-N'-(propan-2-ylideneamino)carbamimidoyl] furan-2-carbothioate
| Molecular Formula | C9H11N3O2S |
|---|---|
| Molecular Weight | 225.06 g/mol |
| LogP | 1.8635 |
| Topological Polar Surface Area | 80.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 225.0572 |
| Heavy Atoms | 15 |
| Complexity | 391.4998 |
Chemical Identifiers
| CAS Number | 92800-62-9 |
|---|---|
| SMILES | CC(=N/N=C(\N)/SC(=O)C1=CC=CO1)C |
Product Overview
S-[(E)-N'-(propan-2-ylideneamino)carbamimidoyl] furan-2-carbothioate (CAS 92800-62-9), with molecular formula C9H11N3O2S and molecular weight 225.06 g/mol. IUPAC: S-[(E)-N'-(propan-2-ylideneamino)carbamimidoyl] furan-2-carbothioate.
Chemical Property Profile of S-[(E)-N'-(propan-2-ylideneamino)carbamimidoyl] furan-2-carbothioate
Property Insights of S-[(E)-N'-(propan-2-ylideneamino)carbamimidoyl] furan-2-carbothioate
The XLogP value of 1.8635 suggests moderate lipophilicity, balancing water solubility and membrane permeability for S-[(E)-N'-(propan-2-ylideneamino)carbamimidoyl] furan-2-carbothioate. The TPSA of 80.95 Ų falls within the moderate polarity range, balancing permeability and solubility for S-[(E)-N'-(propan-2-ylideneamino)carbamimidoyl] furan-2-carbothioate. Following Lipinski's Rule of Five, S-[(E)-N'-(propan-2-ylideneamino)carbamimidoyl] furan-2-carbothioate has 1 hydrogen bond donor(s) and 5 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 S-[(E)-N'-(propan-2-ylideneamino)carbamimidoyl] furan-2-carbothioate?
The CAS number of S-[(E)-N'-(propan-2-ylideneamino)carbamimidoyl] furan-2-carbothioate is 92800-62-9.
What is the molecular formula of S-[(E)-N'-(propan-2-ylideneamino)carbamimidoyl] furan-2-carbothioate?
The molecular formula of S-[(E)-N'-(propan-2-ylideneamino)carbamimidoyl] furan-2-carbothioate is C9H11N3O2S.
What is the molecular weight of S-[(E)-N'-(propan-2-ylideneamino)carbamimidoyl] furan-2-carbothioate?
The molecular weight of S-[(E)-N'-(propan-2-ylideneamino)carbamimidoyl] furan-2-carbothioate is 225.06 g/mol.
Where can I buy S-[(E)-N'-(propan-2-ylideneamino)carbamimidoyl] furan-2-carbothioate?
You can request a quote for S-[(E)-N'-(propan-2-ylideneamino)carbamimidoyl] furan-2-carbothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-[(E)-N'-(propan-2-ylideneamino)carbamimidoyl] furan-2-carbothioate?
Yes, KEHONG BIO provides custom synthesis services for S-[(E)-N'-(propan-2-ylideneamino)carbamimidoyl] furan-2-carbothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.