Carbamimidothioic acid, 9H-fluoren-9-yl ester
TL;DR: Carbamimidothioic acid, 9H-fluoren-9-yl ester (CAS 64850-99-3) is a chemical compound with molecular formula C14H12N2S and molecular weight 240.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9H-fluoren-9-yl carbamimidothioate
Also Known As: 9H-fluoren-9-yl carbamimidothioate, 9H-fluoren-9-ylcarbamimidothioate, Carbamimidothioic acid, 9H-fluoren-9-yl ester, Carbamimidothioic acid,9H-fluoren-9-yl ester
| Molecular Formula | C14H12N2S |
|---|---|
| Molecular Weight | 240.07 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 75.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 240.07211 |
| Heavy Atoms | 17 |
| Complexity | 283.0 |
Chemical Identifiers
| CAS Number | 64850-99-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(C3=CC=CC=C32)SC(=N)N |
| InChIKey | ILMBCGHKQSQDFK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Carbamimidothioic acid, 9H-fluoren-9-yl ester (CAS 64850-99-3), with molecular formula C14H12N2S and molecular weight 240.07 g/mol. IUPAC: 9H-fluoren-9-yl carbamimidothioate.
Chemical Property Profile of Carbamimidothioic acid, 9H-fluoren-9-yl ester
Property Insights of Carbamimidothioic acid, 9H-fluoren-9-yl ester
The XLogP value of 3.1 indicates that Carbamimidothioic acid, 9H-fluoren-9-yl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamimidothioic acid, 9H-fluoren-9-yl ester. Following Lipinski's Rule of Five, Carbamimidothioic acid, 9H-fluoren-9-yl ester has 2 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 Carbamimidothioic acid, 9H-fluoren-9-yl ester?
The CAS number of Carbamimidothioic acid, 9H-fluoren-9-yl ester is 64850-99-3.
What is the molecular formula of Carbamimidothioic acid, 9H-fluoren-9-yl ester?
The molecular formula of Carbamimidothioic acid, 9H-fluoren-9-yl ester is C14H12N2S.
What is the molecular weight of Carbamimidothioic acid, 9H-fluoren-9-yl ester?
The molecular weight of Carbamimidothioic acid, 9H-fluoren-9-yl ester is 240.07 g/mol.
Where can I buy Carbamimidothioic acid, 9H-fluoren-9-yl ester?
You can request a quote for Carbamimidothioic acid, 9H-fluoren-9-yl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamimidothioic acid, 9H-fluoren-9-yl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamimidothioic acid, 9H-fluoren-9-yl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.