F1381-1222
TL;DR: F1381-1222 (CAS 865545-14-8) is a chemical compound with molecular formula C17H17N3O5S and molecular weight 375.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[2-(2,5-dioxopyrrolidin-1-yl)acetyl]imino-3-methyl-1,3-benzothiazole-6-carboxylate
Also Known As: F1381-1222, ethyl (2E)-2-{[2-(2,5-dioxopyrrolidin-1-yl)acetyl]imino}-3-methyl-2,3-dihydro-1,3-benzothiazole-6-carboxylate, ethyl 2-[2-(2,5-dioxopyrrolidin-1-yl)acetyl]imino-3-methyl-1,3-benzothiazole-6-carboxylate, (E)-ethyl 2-((2-(2,5-dioxopyrrolidin-1-yl)acetyl)imino)-3-methyl-2,3-dihydrobenzo[d]thiazole-6-carboxylate
| Molecular Formula | C17H17N3O5S |
|---|---|
| Molecular Weight | 375.09 g/mol |
| LogP | 0.9928 |
| Topological Polar Surface Area | 98.04 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 375.0889 |
| Heavy Atoms | 26 |
| Complexity | 971.93506 |
Chemical Identifiers
| CAS Number | 865545-14-8 |
|---|---|
| SMILES | CCOC(=O)C1=CC2=C(C=C1)N(C(=NC(=O)CN3C(=O)CCC3=O)S2)C |
Product Overview
F1381-1222 (CAS 865545-14-8), with molecular formula C17H17N3O5S and molecular weight 375.09 g/mol. IUPAC: ethyl 2-[2-(2,5-dioxopyrrolidin-1-yl)acetyl]imino-3-methyl-1,3-benzothiazole-6-carboxylate.
Chemical Property Profile of F1381-1222
Property Insights of F1381-1222
The XLogP value of 0.9928 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1381-1222. The TPSA of 98.04 Ų falls within the moderate polarity range, balancing permeability and solubility for F1381-1222. Following Lipinski's Rule of Five, F1381-1222 has 0 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 F1381-1222?
The CAS number of F1381-1222 is 865545-14-8.
What is the molecular formula of F1381-1222?
The molecular formula of F1381-1222 is C17H17N3O5S.
What is the molecular weight of F1381-1222?
The molecular weight of F1381-1222 is 375.09 g/mol.
Where can I buy F1381-1222?
You can request a quote for F1381-1222 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1381-1222?
Yes, KEHONG BIO provides custom synthesis services for F1381-1222 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.