Benzamide, N-2-benzothiazolyl-3-bromo-
TL;DR: Benzamide, N-2-benzothiazolyl-3-bromo- (CAS 139233-21-9) is a chemical compound with molecular formula C14H9BrN2OS and molecular weight 331.9619 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(1,3-benzothiazol-2-yl)-3-bromobenzamide
Also Known As: Benzamide, N-2-benzothiazolyl-3-bromo-, N-(1,3-benzothiazol-2-yl)-3-bromobenzamide, BAS 00403395, N-Benzothiazol-2-yl-3-bromo-benzamide, N-benzothiazol-2-yl(3-bromophenyl)carboxamide
Technical Specifications
| Molecular Formula | C14H9BrN2OS |
| Molecular Weight | 331.9619 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 70.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 331.9619 Da |
| Heavy Atoms | 19 |
| Complexity | 341.0 |
| SMILES | C1=CC=C2C(=C1)N=C(S2)NC(=O)C3=CC(=CC=C3)Br |
| InChIKey | HNSMZZRBTBEMOV-UHFFFAOYSA-N |
Chemical Property Profile of Benzamide, N-2-benzothiazolyl-3-bromo-
Property Insights of Benzamide, N-2-benzothiazolyl-3-bromo-
The XLogP value of 4.2 indicates that Benzamide, N-2-benzothiazolyl-3-bromo- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzamide, N-2-benzothiazolyl-3-bromo-. Following Lipinski's Rule of Five, Benzamide, N-2-benzothiazolyl-3-bromo- 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
What is the CAS number of Benzamide, N-2-benzothiazolyl-3-bromo-?
The CAS number of Benzamide, N-2-benzothiazolyl-3-bromo- is 139233-21-9.
What is the molecular formula of Benzamide, N-2-benzothiazolyl-3-bromo-?
The molecular formula of Benzamide, N-2-benzothiazolyl-3-bromo- is C14H9BrN2OS.
What is the molecular weight of Benzamide, N-2-benzothiazolyl-3-bromo-?
The molecular weight of Benzamide, N-2-benzothiazolyl-3-bromo- is 331.9619 g/mol.
Where can I buy Benzamide, N-2-benzothiazolyl-3-bromo-?
You can request a quote for Benzamide, N-2-benzothiazolyl-3-bromo- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzamide, N-2-benzothiazolyl-3-bromo-?
Yes, CoreyChem provides custom synthesis services for Benzamide, N-2-benzothiazolyl-3-bromo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.