Bionet1_004663
TL;DR: Bionet1_004663 (CAS 383145-45-7) is a chemical compound with molecular formula C18H14F3NO2S and molecular weight 365.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(6-methyl-2,3-dihydrothiochromen-4-ylidene)amino] 3-(trifluoromethyl)benzoate
Also Known As: Bionet1_004663, 6-methyl-4-({[3-(trifluoromethyl)benzoyl]oxy}imino)thiochromane, [(4E)-6-methyl-3,4-dihydro-2H-1-benzothiopyran-4-ylidene]amino 3-(trifluoromethyl)benzoate, [(6-methyl-2,3-dihydrothiochromen-4-ylidene)amino] 3-(trifluoromethyl)benzoate
| Molecular Formula | C18H14F3NO2S |
|---|---|
| Molecular Weight | 365.07 g/mol |
| LogP | 5.07072 |
| Topological Polar Surface Area | 38.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 365.06973 |
| Heavy Atoms | 25 |
| Complexity | 846.4551 |
Chemical Identifiers
| CAS Number | 383145-45-7 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)SCCC2=NOC(=O)C3=CC(=CC=C3)C(F)(F)F |
Product Overview
Bionet1_004663 (CAS 383145-45-7), with molecular formula C18H14F3NO2S and molecular weight 365.07 g/mol. IUPAC: [(6-methyl-2,3-dihydrothiochromen-4-ylidene)amino] 3-(trifluoromethyl)benzoate.
Chemical Property Profile of Bionet1_004663
Property Insights of Bionet1_004663
The XLogP value of 5.07072 indicates that Bionet1_004663 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.66 Ų, Bionet1_004663 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bionet1_004663 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bionet1_004663?
The CAS number of Bionet1_004663 is 383145-45-7.
What is the molecular formula of Bionet1_004663?
The molecular formula of Bionet1_004663 is C18H14F3NO2S.
What is the molecular weight of Bionet1_004663?
The molecular weight of Bionet1_004663 is 365.07 g/mol.
Where can I buy Bionet1_004663?
You can request a quote for Bionet1_004663 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_004663?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_004663 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.