F1012-0068
TL;DR: F1012-0068 (CAS 327094-33-7) is a chemical compound with molecular formula C18H15FN2OS and molecular weight 326.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-1-(2-ethylsulfanylbenzimidazol-1-yl)-3-(4-fluorophenyl)prop-2-en-1-one
Also Known As: F1012-0068, (2E)-1-[2-(ethylsulfanyl)-1H-1,3-benzodiazol-1-yl]-3-(4-fluorophenyl)prop-2-en-1-one, (2E)-1-[2-(ethylsulfanyl)-1H-benzimidazol-1-yl]-3-(4-fluorophenyl)prop-2-en-1-one, (E)-1-(2-ethylsulfanylbenzimidazol-1-yl)-3-(4-fluorophenyl)prop-2-en-1-one, (E)-1-(2-(ethylthio)-1H-benzo[d]imidazol-1-yl)-3-(4-fluorophenyl)prop-2-en-1-one
| Molecular Formula | C18H15FN2OS |
|---|---|
| Molecular Weight | 326.09 g/mol |
| LogP | 4.641 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 326.0889 |
| Heavy Atoms | 23 |
| Complexity | 868.3639 |
Chemical Identifiers
| CAS Number | 327094-33-7 |
|---|---|
| SMILES | CCSC1=NC2=CC=CC=C2N1C(=O)/C=C/C3=CC=C(C=C3)F |
Product Overview
F1012-0068 (CAS 327094-33-7), with molecular formula C18H15FN2OS and molecular weight 326.09 g/mol. IUPAC: (E)-1-(2-ethylsulfanylbenzimidazol-1-yl)-3-(4-fluorophenyl)prop-2-en-1-one.
Chemical Property Profile of F1012-0068
Property Insights of F1012-0068
The XLogP value of 4.641 indicates that F1012-0068 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, F1012-0068 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F1012-0068 has 0 hydrogen bond donor(s) and 3 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 F1012-0068?
The CAS number of F1012-0068 is 327094-33-7.
What is the molecular formula of F1012-0068?
The molecular formula of F1012-0068 is C18H15FN2OS.
What is the molecular weight of F1012-0068?
The molecular weight of F1012-0068 is 326.09 g/mol.
Where can I buy F1012-0068?
You can request a quote for F1012-0068 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1012-0068?
Yes, KEHONG BIO provides custom synthesis services for F1012-0068 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.