4,6-二甲基-2-苯并噻唑胺
TL;DR: 4,6-二甲基-2-苯并噻唑胺 (CAS 64036-71-1) is a chemical compound with molecular formula C9H10N2S and molecular weight 178.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-二甲基-2-苯并噻唑胺
4,6-dimethyl-1,3-benzothiazol-2-amine
Also Known As: 4,6-Dimethyl-benzothiazol-2-ylamine, 4,6-Dimethyl-1,3-benzothiazol-2-amine, 4,6-dimethylbenzo[d]thiazol-2-amine, 4,6-Dimethyl-2-aminobenzothiazole, 2-amino-4,6-dimethylbenzothiazole
| Molecular Formula | C9H10N2S |
|---|---|
| Molecular Weight | 178.06 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 67.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 178.05647 |
| Heavy Atoms | 12 |
| Complexity | 174.0 |
Chemical Identifiers
| CAS Number | 64036-71-1 |
|---|---|
| SMILES | CC1=CC(=C2C(=C1)SC(=N2)N)C |
| InChIKey | JJNKKYPHNWIYFW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,6-二甲基-2-苯并噻唑胺 (CAS 64036-71-1), with molecular formula C9H10N2S and molecular weight 178.06 g/mol. IUPAC: 4,6-dimethyl-1,3-benzothiazol-2-amine.
Chemical Property Profile of 4,6-二甲基-2-苯并噻唑胺
Property Insights of 4,6-二甲基-2-苯并噻唑胺
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,6-二甲基-2-苯并噻唑胺. The TPSA of 67.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,6-二甲基-2-苯并噻唑胺. Following Lipinski's Rule of Five, 4,6-二甲基-2-苯并噻唑胺 has 1 hydrogen bond donor(s) and 3 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 4,6-二甲基-2-苯并噻唑胺?
The CAS number of 4,6-二甲基-2-苯并噻唑胺 is 64036-71-1.
What is the molecular formula of 4,6-二甲基-2-苯并噻唑胺?
The molecular formula of 4,6-二甲基-2-苯并噻唑胺 is C9H10N2S.
What is the molecular weight of 4,6-二甲基-2-苯并噻唑胺?
The molecular weight of 4,6-二甲基-2-苯并噻唑胺 is 178.06 g/mol.
Where can I buy 4,6-二甲基-2-苯并噻唑胺?
You can request a quote for 4,6-二甲基-2-苯并噻唑胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-二甲基-2-苯并噻唑胺?
Yes, KEHONG BIO provides custom synthesis services for 4,6-二甲基-2-苯并噻唑胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.