BAS 00247164
TL;DR: BAS 00247164 (CAS 301331-96-4) is a chemical compound with molecular formula C18H14F3N3O2S and molecular weight 393.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-methoxy-2-(4-methylphenyl)-2-(trifluoromethyl)-3H-[1,3,5]triazino[2,1-b][1,3]benzothiazol-4-one
Also Known As: BAS 00247164, AB00709291-01, BRD-A83881498-001-01-7, F1315-0097, 8-methoxy-2-(p-tolyl)-2-(trifluoromethyl)-2H-benzo[4,5]thiazolo[3,2-a][1,3,5]triazin-4(3H)-one
| Molecular Formula | C18H14F3N3O2S |
|---|---|
| Molecular Weight | 393.08 g/mol |
| LogP | 4.41022 |
| Topological Polar Surface Area | 53.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 393.0759 |
| Heavy Atoms | 27 |
| Complexity | 959.31445 |
Chemical Identifiers
| CAS Number | 301331-96-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2(NC(=O)N3C4=C(C=C(C=C4)OC)SC3=N2)C(F)(F)F |
Product Overview
BAS 00247164 (CAS 301331-96-4), with molecular formula C18H14F3N3O2S and molecular weight 393.08 g/mol. IUPAC: 8-methoxy-2-(4-methylphenyl)-2-(trifluoromethyl)-3H-[1,3,5]triazino[2,1-b][1,3]benzothiazol-4-one.
Chemical Property Profile of BAS 00247164
Property Insights of BAS 00247164
The XLogP value of 4.41022 indicates that BAS 00247164 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.93 Ų, BAS 00247164 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00247164 has 1 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 BAS 00247164?
The CAS number of BAS 00247164 is 301331-96-4.
What is the molecular formula of BAS 00247164?
The molecular formula of BAS 00247164 is C18H14F3N3O2S.
What is the molecular weight of BAS 00247164?
The molecular weight of BAS 00247164 is 393.08 g/mol.
Where can I buy BAS 00247164?
You can request a quote for BAS 00247164 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00247164?
Yes, KEHONG BIO provides custom synthesis services for BAS 00247164 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.