N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)formamide
TL;DR: N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)formamide (CAS 116855-73-3) is a chemical compound with molecular formula C8H6N2OS2 and molecular weight 209.99216 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)formamide
Also Known As: N-(2-MERCAPTO-BENZOTHIAZOL-6-YL)-FORMAMIDE, N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)formamide, Formamide, N-(2,3-dihydro-2-thioxo-6-benzothiazolyl)- (9CI), N-(2-sulfanylidene-3H-benzothiazol-6-yl)formamide, N-(2-Thioxo-2,3-dihydro-1,3-benzothiazol-6-yl)formamide
Technical Specifications
| Molecular Formula | C8H6N2OS2 |
| Molecular Weight | 209.99216 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 98.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 209.99216 Da |
| Heavy Atoms | 13 |
| Complexity | 234.0 |
| SMILES | C1=CC2=C(C=C1NC=O)SC(=S)N2 |
| InChIKey | UWNCYYSAPQELAU-UHFFFAOYSA-N |
Chemical Property Profile of N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)formamide
Property Insights of N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)formamide
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)formamide. The TPSA of 98.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)formamide. Following Lipinski's Rule of Five, N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)formamide has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)formamide?
The CAS number of N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)formamide is 116855-73-3.
What is the molecular formula of N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)formamide?
The molecular formula of N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)formamide is C8H6N2OS2.
What is the molecular weight of N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)formamide?
The molecular weight of N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)formamide is 209.99216 g/mol.
Where can I buy N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)formamide?
You can request a quote for N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)formamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)formamide?
Yes, CoreyChem provides custom synthesis services for N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)formamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.