N-[(1,3-Benzothiazol-2-yl)carbamoyl]-2,6-difluorobenzamide
TL;DR: N-[(1,3-Benzothiazol-2-yl)carbamoyl]-2,6-difluorobenzamide (CAS 64862-32-4) is a chemical compound with molecular formula C15H9F2N3O2S and molecular weight 333.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzothiazol-2-ylcarbamoyl)-2,6-difluorobenzamide
Also Known As: N-(1,3-benzothiazol-2-ylcarbamoyl)-2,6-difluorobenzamide, N-[(1,3-Benzothiazol-2-yl)carbamoyl]-2,6-difluorobenzamide
| Molecular Formula | C15H9F2N3O2S |
|---|---|
| Molecular Weight | 333.04 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 99.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 333.03836 |
| Heavy Atoms | 23 |
| Complexity | 458.0 |
Chemical Identifiers
| CAS Number | 64862-32-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)NC(=O)NC(=O)C3=C(C=CC=C3F)F |
| InChIKey | PNSJEKAPGVBLOT-UHFFFAOYSA-N |
Product Overview
N-[(1,3-Benzothiazol-2-yl)carbamoyl]-2,6-difluorobenzamide (CAS 64862-32-4), with molecular formula C15H9F2N3O2S and molecular weight 333.04 g/mol. IUPAC: N-(1,3-benzothiazol-2-ylcarbamoyl)-2,6-difluorobenzamide.
Chemical Property Profile of N-[(1,3-Benzothiazol-2-yl)carbamoyl]-2,6-difluorobenzamide
Property Insights of N-[(1,3-Benzothiazol-2-yl)carbamoyl]-2,6-difluorobenzamide
The XLogP value of 3.9 indicates that N-[(1,3-Benzothiazol-2-yl)carbamoyl]-2,6-difluorobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(1,3-Benzothiazol-2-yl)carbamoyl]-2,6-difluorobenzamide. Following Lipinski's Rule of Five, N-[(1,3-Benzothiazol-2-yl)carbamoyl]-2,6-difluorobenzamide has 2 hydrogen bond donor(s) and 6 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 N-[(1,3-Benzothiazol-2-yl)carbamoyl]-2,6-difluorobenzamide?
The CAS number of N-[(1,3-Benzothiazol-2-yl)carbamoyl]-2,6-difluorobenzamide is 64862-32-4.
What is the molecular formula of N-[(1,3-Benzothiazol-2-yl)carbamoyl]-2,6-difluorobenzamide?
The molecular formula of N-[(1,3-Benzothiazol-2-yl)carbamoyl]-2,6-difluorobenzamide is C15H9F2N3O2S.
What is the molecular weight of N-[(1,3-Benzothiazol-2-yl)carbamoyl]-2,6-difluorobenzamide?
The molecular weight of N-[(1,3-Benzothiazol-2-yl)carbamoyl]-2,6-difluorobenzamide is 333.04 g/mol.
Where can I buy N-[(1,3-Benzothiazol-2-yl)carbamoyl]-2,6-difluorobenzamide?
You can request a quote for N-[(1,3-Benzothiazol-2-yl)carbamoyl]-2,6-difluorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(1,3-Benzothiazol-2-yl)carbamoyl]-2,6-difluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(1,3-Benzothiazol-2-yl)carbamoyl]-2,6-difluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.