RefChem:307234
TL;DR: RefChem:307234 (CAS 82746-90-5) is a chemical compound with molecular formula C17H14Cl2N6S2 and molecular weight 436.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[5-(3,4-dichlorophenyl)tetrazol-1-yl]methyl]-2-ethylsulfanyl-1,3-benzothiazol-6-amine
Also Known As: 6-Benzothiazolamine, N-((5-(3,4-dichlorophenyl)-1H-tetrazol-1-yl)methyl)-2-(ethylthio)-, N-((5-(3,4-Dichlorophenyl)-1H-tetrazol-1-yl)methyl)-2-(ethylthio)-6-benzothiazolamine, N-[[5-(3,4-dichlorophenyl)tetrazol-1-yl]methyl]-2-ethylsulfanyl-1,3-benzothiazol-6-amine, N-{[5-(3,4-Dichlorophenyl)-1H-tetrazol-1-yl]methyl}-2-(ethylsulfanyl)-1,3-benzothiazol-6-amine, 6-BENZOTHIAZOLAMINE, N-((5-(3,4-DICHLOROPHENYL)-1H-TETRAZOL-1-YL)METHYL)-2-(ETHY
| Molecular Formula | C17H14Cl2N6S2 |
|---|---|
| Molecular Weight | 436.01 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 122.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 436.00986 |
| Heavy Atoms | 27 |
| Complexity | 492.0 |
Chemical Identifiers
| CAS Number | 82746-90-5 |
|---|---|
| SMILES | CCSC1=NC2=C(S1)C=C(C=C2)NCN3C(=NN=N3)C4=CC(=C(C=C4)Cl)Cl |
| InChIKey | JPIRPVOLLYNEDR-UHFFFAOYSA-N |
Product Overview
RefChem:307234 (CAS 82746-90-5), with molecular formula C17H14Cl2N6S2 and molecular weight 436.01 g/mol. IUPAC: N-[[5-(3,4-dichlorophenyl)tetrazol-1-yl]methyl]-2-ethylsulfanyl-1,3-benzothiazol-6-amine.
Chemical Property Profile of RefChem:307234
Property Insights of RefChem:307234
The XLogP value of 5.9 indicates that RefChem:307234 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:307234. Following Lipinski's Rule of Five, RefChem:307234 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:307234?
The CAS number of RefChem:307234 is 82746-90-5.
What is the molecular formula of RefChem:307234?
The molecular formula of RefChem:307234 is C17H14Cl2N6S2.
What is the molecular weight of RefChem:307234?
The molecular weight of RefChem:307234 is 436.01 g/mol.
Where can I buy RefChem:307234?
You can request a quote for RefChem:307234 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:307234?
Yes, KEHONG BIO provides custom synthesis services for RefChem:307234 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.