N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3-phenoxypropanamide
TL;DR: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3-phenoxypropanamide (CAS 868230-63-1) is a chemical compound with molecular formula C18H18N2O4S and molecular weight 358.09872 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3-phenoxypropanamide
Also Known As: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3-phenoxypropanamide, N-(4,7-dimethoxybenzo[d]thiazol-2-yl)-3-phenoxypropanamide, F1813-0417
Technical Specifications
| Molecular Formula | C18H18N2O4S |
| Molecular Weight | 358.09872 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 97.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 358.09872 Da |
| Heavy Atoms | 25 |
| Complexity | 433.0 |
| SMILES | COC1=C2C(=C(C=C1)OC)SC(=N2)NC(=O)CCOC3=CC=CC=C3 |
| InChIKey | IFEYMYHSKONJRW-UHFFFAOYSA-N |
Chemical Property Profile of N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3-phenoxypropanamide
Property Insights of N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3-phenoxypropanamide
The XLogP value of 3.4 indicates that N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3-phenoxypropanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3-phenoxypropanamide. Following Lipinski's Rule of Five, N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3-phenoxypropanamide has 1 hydrogen bond donor(s) and 6 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-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3-phenoxypropanamide?
The CAS number of N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3-phenoxypropanamide is 868230-63-1.
What is the molecular formula of N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3-phenoxypropanamide?
The molecular formula of N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3-phenoxypropanamide is C18H18N2O4S.
What is the molecular weight of N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3-phenoxypropanamide?
The molecular weight of N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3-phenoxypropanamide is 358.09872 g/mol.
Where can I buy N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3-phenoxypropanamide?
You can request a quote for N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3-phenoxypropanamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3-phenoxypropanamide?
Yes, CoreyChem provides custom synthesis services for N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3-phenoxypropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.