BAS 01257282
TL;DR: BAS 01257282 (CAS 337340-74-6) is a chemical compound with molecular formula C15H11F3N4OS and molecular weight 352.06 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-(prop-2-enyliminomethyl)-5-(trifluoromethyl)-1H-pyrazol-3-one
Also Known As: BAS 01257282, (4E)-2-(1,3-benzothiazol-2-yl)-4-[(prop-2-enylamino)methylidene]-5-(trifluoromethyl)pyrazol-3-one, (4Z)-2-(1,3-benzothiazol-2-yl)-4-[(prop-2-en-1-ylamino)methylidene]-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one, (4Z)-2-(1,3-benzothiazol-2-yl)-4-[(prop-2-enylamino)methylidene]-5-(trifluoromethyl)pyrazol-3-one, (E)-4-((allylimino)methyl)-2-(benzo[d]thiazol-2-yl)-5-(trifluoromethyl)-1H-pyrazol-3(2H)-one
| Molecular Formula | C15H11F3N4OS |
|---|---|
| Molecular Weight | 352.06 g/mol |
| LogP | 3.399 |
| Topological Polar Surface Area | 63.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 352.06058 |
| Heavy Atoms | 24 |
| Complexity | 947.6693 |
Chemical Identifiers
| CAS Number | 337340-74-6 |
|---|---|
| SMILES | C=CCN=CC1=C(NN(C1=O)C2=NC3=CC=CC=C3S2)C(F)(F)F |
Product Overview
BAS 01257282 (CAS 337340-74-6), with molecular formula C15H11F3N4OS and molecular weight 352.06 g/mol. IUPAC: 2-(1,3-benzothiazol-2-yl)-4-(prop-2-enyliminomethyl)-5-(trifluoromethyl)-1H-pyrazol-3-one.
Chemical Property Profile of BAS 01257282
Property Insights of BAS 01257282
The XLogP value of 3.399 indicates that BAS 01257282 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.04 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01257282. Following Lipinski's Rule of Five, BAS 01257282 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 01257282?
The CAS number of BAS 01257282 is 337340-74-6.
What is the molecular formula of BAS 01257282?
The molecular formula of BAS 01257282 is C15H11F3N4OS.
What is the molecular weight of BAS 01257282?
The molecular weight of BAS 01257282 is 352.06 g/mol.
Where can I buy BAS 01257282?
You can request a quote for BAS 01257282 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01257282?
Yes, KEHONG BIO provides custom synthesis services for BAS 01257282 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.