1,3,4-Thiadiazole-2-thiol, 5-(methylamino)-, hydrochloride
TL;DR: 1,3,4-Thiadiazole-2-thiol, 5-(methylamino)-, hydrochloride (CAS 63503-51-5) is a chemical compound with molecular formula C3H6ClN3S2 and molecular weight 182.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(methylamino)-3H-1,3,4-thiadiazole-2-thione;hydrochloride
Also Known As: 5-Methylamino-1,3,4-thiadiazole-2-thiol hydrochloride, 1,3,4-Thiadiazole-2-thiol, 5-(methylamino)-, hydrochloride, 2-Methylamino-1,3,4-thiadiazole-5-thione hydrochloride, 5-(methylamino)-3H-1,3,4-thiadiazole-2-thione hydrochloride, 5-(Methylamino)-1,3,4-thiadiazole-2(3H)-thione--hydrogen chloride (1/1)
| Molecular Formula | C3H6ClN3S2 |
|---|---|
| Molecular Weight | 182.97 g/mol |
| LogP | 1.66419 |
| Topological Polar Surface Area | 40.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 182.96916 |
| Heavy Atoms | 9 |
| Complexity | 216.83247 |
Chemical Identifiers
| CAS Number | 63503-51-5 |
|---|---|
| SMILES | CNC1=NNC(=S)S1.Cl |
Product Overview
1,3,4-Thiadiazole-2-thiol, 5-(methylamino)-, hydrochloride (CAS 63503-51-5), with molecular formula C3H6ClN3S2 and molecular weight 182.97 g/mol. IUPAC: 5-(methylamino)-3H-1,3,4-thiadiazole-2-thione;hydrochloride.
Chemical Property Profile of 1,3,4-Thiadiazole-2-thiol, 5-(methylamino)-, hydrochloride
Property Insights of 1,3,4-Thiadiazole-2-thiol, 5-(methylamino)-, hydrochloride
The XLogP value of 1.66419 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3,4-Thiadiazole-2-thiol, 5-(methylamino)-, hydrochloride. With a topological polar surface area (TPSA) of 40.71 Ų, 1,3,4-Thiadiazole-2-thiol, 5-(methylamino)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,4-Thiadiazole-2-thiol, 5-(methylamino)-, hydrochloride has 2 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 1,3,4-Thiadiazole-2-thiol, 5-(methylamino)-, hydrochloride?
The CAS number of 1,3,4-Thiadiazole-2-thiol, 5-(methylamino)-, hydrochloride is 63503-51-5.
What is the molecular formula of 1,3,4-Thiadiazole-2-thiol, 5-(methylamino)-, hydrochloride?
The molecular formula of 1,3,4-Thiadiazole-2-thiol, 5-(methylamino)-, hydrochloride is C3H6ClN3S2.
What is the molecular weight of 1,3,4-Thiadiazole-2-thiol, 5-(methylamino)-, hydrochloride?
The molecular weight of 1,3,4-Thiadiazole-2-thiol, 5-(methylamino)-, hydrochloride is 182.97 g/mol.
Where can I buy 1,3,4-Thiadiazole-2-thiol, 5-(methylamino)-, hydrochloride?
You can request a quote for 1,3,4-Thiadiazole-2-thiol, 5-(methylamino)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,4-Thiadiazole-2-thiol, 5-(methylamino)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1,3,4-Thiadiazole-2-thiol, 5-(methylamino)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.