2-(Benzotriazol-1-ylmethyl)-1,3-benzothiazole
TL;DR: 2-(Benzotriazol-1-ylmethyl)-1,3-benzothiazole (CAS 156272-74-1) is a chemical compound with molecular formula C14H10N4S and molecular weight 266.06262 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(benzotriazol-1-ylmethyl)-1,3-benzothiazole
Also Known As: 1-(1,3-Benzothiazol-2-ylmethyl)-1H-1,2,3-benzotriazole, 2-(benzotriazol-1-ylmethyl)-1,3-benzothiazole, 1-[(Benzothiazole-2-yl)methyl]-1H-benzotriazole, J1.186.202K, 1-[(1,3-benzothiazol-2-yl)methyl]-1H-1,2,3-benzotriazole
Technical Specifications
| Molecular Formula | C14H10N4S |
| Molecular Weight | 266.06262 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 71.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 266.06262 Da |
| Heavy Atoms | 19 |
| Complexity | 327.0 |
| SMILES | C1=CC=C2C(=C1)N=NN2CC3=NC4=CC=CC=C4S3 |
| InChIKey | BCNOFLRBPYRFPU-UHFFFAOYSA-N |
Chemical Property Profile of 2-(Benzotriazol-1-ylmethyl)-1,3-benzothiazole
Property Insights of 2-(Benzotriazol-1-ylmethyl)-1,3-benzothiazole
The XLogP value of 3.2 indicates that 2-(Benzotriazol-1-ylmethyl)-1,3-benzothiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Benzotriazol-1-ylmethyl)-1,3-benzothiazole. Following Lipinski's Rule of Five, 2-(Benzotriazol-1-ylmethyl)-1,3-benzothiazole has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(Benzotriazol-1-ylmethyl)-1,3-benzothiazole?
The CAS number of 2-(Benzotriazol-1-ylmethyl)-1,3-benzothiazole is 156272-74-1.
What is the molecular formula of 2-(Benzotriazol-1-ylmethyl)-1,3-benzothiazole?
The molecular formula of 2-(Benzotriazol-1-ylmethyl)-1,3-benzothiazole is C14H10N4S.
What is the molecular weight of 2-(Benzotriazol-1-ylmethyl)-1,3-benzothiazole?
The molecular weight of 2-(Benzotriazol-1-ylmethyl)-1,3-benzothiazole is 266.06262 g/mol.
Where can I buy 2-(Benzotriazol-1-ylmethyl)-1,3-benzothiazole?
You can request a quote for 2-(Benzotriazol-1-ylmethyl)-1,3-benzothiazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(Benzotriazol-1-ylmethyl)-1,3-benzothiazole?
Yes, CoreyChem provides custom synthesis services for 2-(Benzotriazol-1-ylmethyl)-1,3-benzothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.