AB00684715-01
TL;DR: AB00684715-01 (CAS 851807-75-5) is a chemical compound with molecular formula C17H14F3N3OS and molecular weight 365.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(pyridin-3-ylmethylsulfanyl)-4,5-dihydroimidazol-1-yl]-[4-(trifluoromethyl)phenyl]methanone
Also Known As: AB00684715-01, F0630-1714, 3-[({1-[4-(trifluoromethyl)benzoyl]-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)methyl]pyridine, (2-((pyridin-3-ylmethyl)thio)-4,5-dihydro-1H-imidazol-1-yl)(4-(trifluoromethyl)phenyl)methanone, [2-(pyridin-3-ylmethylsulfanyl)-4,5-dihydroimidazol-1-yl]-[4-(trifluoromethyl)phenyl]methanone
| Molecular Formula | C17H14F3N3OS |
|---|---|
| Molecular Weight | 365.08 g/mol |
| LogP | 3.8456 |
| Topological Polar Surface Area | 45.56 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 365.08096 |
| Heavy Atoms | 25 |
| Complexity | 775.9751 |
Chemical Identifiers
| CAS Number | 851807-75-5 |
|---|---|
| SMILES | C1CN(C(=N1)SCC2=CN=CC=C2)C(=O)C3=CC=C(C=C3)C(F)(F)F |
Product Overview
AB00684715-01 (CAS 851807-75-5), with molecular formula C17H14F3N3OS and molecular weight 365.08 g/mol. IUPAC: [2-(pyridin-3-ylmethylsulfanyl)-4,5-dihydroimidazol-1-yl]-[4-(trifluoromethyl)phenyl]methanone.
Chemical Property Profile of AB00684715-01
Property Insights of AB00684715-01
The XLogP value of 3.8456 indicates that AB00684715-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.56 Ų, AB00684715-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00684715-01 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 AB00684715-01?
The CAS number of AB00684715-01 is 851807-75-5.
What is the molecular formula of AB00684715-01?
The molecular formula of AB00684715-01 is C17H14F3N3OS.
What is the molecular weight of AB00684715-01?
The molecular weight of AB00684715-01 is 365.08 g/mol.
Where can I buy AB00684715-01?
You can request a quote for AB00684715-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00684715-01?
Yes, KEHONG BIO provides custom synthesis services for AB00684715-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.