F1381-1126
TL;DR: F1381-1126 (CAS 865545-07-9) is a chemical compound with molecular formula C18H15BrN2O3S and molecular weight 418.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(4-bromobenzoyl)imino-3-methyl-1,3-benzothiazole-6-carboxylate
Also Known As: F1381-1126, (E)-ethyl 2-((4-bromobenzoyl)imino)-3-methyl-2,3-dihydrobenzo[d]thiazole-6-carboxylate, ethyl (2E)-2-[(4-bromobenzoyl)imino]-3-methyl-2,3-dihydro-1,3-benzothiazole-6-carboxylate, ethyl 2-(4-bromobenzoyl)imino-3-methyl-1,3-benzothiazole-6-carboxylate, Ethyl 2-(4-bromobenzoyl)imino-3-methyl-benzothiazole-6-carboxylate
| Molecular Formula | C18H15BrN2O3S |
|---|---|
| Molecular Weight | 418.00 g/mol |
| LogP | 3.9201 |
| Topological Polar Surface Area | 60.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 417.9987 |
| Heavy Atoms | 25 |
| Complexity | 1018.97235 |
Chemical Identifiers
| CAS Number | 865545-07-9 |
|---|---|
| SMILES | CCOC(=O)C1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=C(C=C3)Br)S2)C |
Product Overview
F1381-1126 (CAS 865545-07-9), with molecular formula C18H15BrN2O3S and molecular weight 418.00 g/mol. IUPAC: ethyl 2-(4-bromobenzoyl)imino-3-methyl-1,3-benzothiazole-6-carboxylate.
Chemical Property Profile of F1381-1126
Property Insights of F1381-1126
The XLogP value of 3.9201 indicates that F1381-1126 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.66 Ų falls within the moderate polarity range, balancing permeability and solubility for F1381-1126. Following Lipinski's Rule of Five, F1381-1126 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
Frequently Asked Questions
What is the CAS number of F1381-1126?
The CAS number of F1381-1126 is 865545-07-9.
What is the molecular formula of F1381-1126?
The molecular formula of F1381-1126 is C18H15BrN2O3S.
What is the molecular weight of F1381-1126?
The molecular weight of F1381-1126 is 418.00 g/mol.
Where can I buy F1381-1126?
You can request a quote for F1381-1126 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1381-1126?
Yes, KEHONG BIO provides custom synthesis services for F1381-1126 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.