5-(Adamantan-1-yl)-1,3,4-thiadiazol-2-amine
TL;DR: 5-(Adamantan-1-yl)-1,3,4-thiadiazol-2-amine (CAS 26718-32-1) is a chemical compound with molecular formula C12H17N3S and molecular weight 235.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(1-adamantyl)-1,3,4-thiadiazol-2-amine
Also Known As: 5-Adamantan-1-yl-[1,3,4]thiadiazol-2-ylamine, 5-(adamantan-1-yl)-1,3,4-thiadiazol-2-amine, 5-(1-adamantyl)-1,3,4-thiadiazol-2-amine, 2-(1-adamantyl)-5-amino-1,3,4-thiadiazole, 1,3,4-Thiadiazol-2-amine, 5-tricyclo[3.3.1.13,7]dec-1-yl-
| Molecular Formula | C12H17N3S |
|---|---|
| Molecular Weight | 235.11 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 80.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 235.11432 |
| Heavy Atoms | 16 |
| Complexity | 265.0 |
Chemical Identifiers
| CAS Number | 26718-32-1 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)C4=NN=C(S4)N |
| InChIKey | FBIPRWDBYYCKHA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-(Adamantan-1-yl)-1,3,4-thiadiazol-2-amine (CAS 26718-32-1), with molecular formula C12H17N3S and molecular weight 235.11 g/mol. IUPAC: 5-(1-adamantyl)-1,3,4-thiadiazol-2-amine.
Chemical Property Profile of 5-(Adamantan-1-yl)-1,3,4-thiadiazol-2-amine
Property Insights of 5-(Adamantan-1-yl)-1,3,4-thiadiazol-2-amine
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Adamantan-1-yl)-1,3,4-thiadiazol-2-amine. The TPSA of 80.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(Adamantan-1-yl)-1,3,4-thiadiazol-2-amine. Following Lipinski's Rule of Five, 5-(Adamantan-1-yl)-1,3,4-thiadiazol-2-amine 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 5-(Adamantan-1-yl)-1,3,4-thiadiazol-2-amine?
The CAS number of 5-(Adamantan-1-yl)-1,3,4-thiadiazol-2-amine is 26718-32-1.
What is the molecular formula of 5-(Adamantan-1-yl)-1,3,4-thiadiazol-2-amine?
The molecular formula of 5-(Adamantan-1-yl)-1,3,4-thiadiazol-2-amine is C12H17N3S.
What is the molecular weight of 5-(Adamantan-1-yl)-1,3,4-thiadiazol-2-amine?
The molecular weight of 5-(Adamantan-1-yl)-1,3,4-thiadiazol-2-amine is 235.11 g/mol.
Where can I buy 5-(Adamantan-1-yl)-1,3,4-thiadiazol-2-amine?
You can request a quote for 5-(Adamantan-1-yl)-1,3,4-thiadiazol-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Adamantan-1-yl)-1,3,4-thiadiazol-2-amine?
Yes, KEHONG BIO provides custom synthesis services for 5-(Adamantan-1-yl)-1,3,4-thiadiazol-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.