BAS 01174215
TL;DR: BAS 01174215 (CAS 371956-95-5) is a chemical compound with molecular formula C23H18F3N5OS and molecular weight 469.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzothiazol-2-yl)-4-[N-[2-(1H-indol-3-yl)ethyl]-C-methylcarbonimidoyl]-5-(trifluoromethyl)-1H-pyrazol-3-one
Also Known As: BAS 01174215, (4Z)-2-(1,3-benzothiazol-2-yl)-4-[1-[2-(1H-indol-3-yl)ethylamino]ethylidene]-5-(trifluoromethyl)pyrazol-3-one, (E)-4-(1-((2-(1H-indol-3-yl)ethyl)amino)ethylidene)-1-(benzo[d]thiazol-2-yl)-3-(trifluoromethyl)-1H-pyrazol-5(4H)-one, 2-(1,3-Benzothiazol-2-yl)-4-[N-[2-(1H-indol-3-yl)ethyl]-C-methylcarbonimidoyl]-5-(trifluoromethyl)-1H-pyrazol-3-one, 2-(1,3-benzothiazol-2-yl)-4-{(1E)-N-[2-(1H-indol-3-yl)ethyl]ethanimidoyl}-5-(trifluoromethyl)-1,2-dihydro-3H-pyrazol-3-one
| Molecular Formula | C23H18F3N5OS |
|---|---|
| Molecular Weight | 469.12 g/mol |
| LogP | 5.3271 |
| Topological Polar Surface Area | 78.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 469.1184 |
| Heavy Atoms | 33 |
| Complexity | 1520.6721 |
Chemical Identifiers
| CAS Number | 371956-95-5 |
|---|---|
| SMILES | CC(=NCCC1=CNC2=CC=CC=C21)C3=C(NN(C3=O)C4=NC5=CC=CC=C5S4)C(F)(F)F |
Product Overview
BAS 01174215 (CAS 371956-95-5), with molecular formula C23H18F3N5OS and molecular weight 469.12 g/mol. IUPAC: 2-(1,3-benzothiazol-2-yl)-4-[N-[2-(1H-indol-3-yl)ethyl]-C-methylcarbonimidoyl]-5-(trifluoromethyl)-1H-pyrazol-3-one.
Chemical Property Profile of BAS 01174215
Property Insights of BAS 01174215
The XLogP value of 5.3271 indicates that BAS 01174215 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.83 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01174215. Following Lipinski's Rule of Five, BAS 01174215 has 2 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 BAS 01174215?
The CAS number of BAS 01174215 is 371956-95-5.
What is the molecular formula of BAS 01174215?
The molecular formula of BAS 01174215 is C23H18F3N5OS.
What is the molecular weight of BAS 01174215?
The molecular weight of BAS 01174215 is 469.12 g/mol.
Where can I buy BAS 01174215?
You can request a quote for BAS 01174215 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01174215?
Yes, KEHONG BIO provides custom synthesis services for BAS 01174215 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.