BAS 01174036
TL;DR: BAS 01174036 (CAS 354991-87-0) is a chemical compound with molecular formula C19H14F3N3OS2 and molecular weight 421.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-methylimidazol-2-yl)sulfanyl-1-[2-(trifluoromethyl)phenothiazin-10-yl]ethanone
Also Known As: BAS 01174036, AJ-292/13095467, 2-(1-methylimidazol-2-yl)sulfanyl-1-[2-(trifluoromethyl)phenothiazin-10-yl]ethanone, 2-(1-methylimidazol-2-ylthio)-1-[2-(trifluoromethyl)phenothiazin-10-yl]ethan-1 -one, 1-methyl-1H-imidazol-2-yl 2-oxo-2-[2-(trifluoromethyl)-10H-phenothiazin-10-yl]ethyl sulfide
| Molecular Formula | C19H14F3N3OS2 |
|---|---|
| Molecular Weight | 421.05 g/mol |
| LogP | 5.3605 |
| Topological Polar Surface Area | 38.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 421.05304 |
| Heavy Atoms | 28 |
| Complexity | 1048.8983 |
Chemical Identifiers
| CAS Number | 354991-87-0 |
|---|---|
| SMILES | CN1C=CN=C1SCC(=O)N2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F |
Product Overview
BAS 01174036 (CAS 354991-87-0), with molecular formula C19H14F3N3OS2 and molecular weight 421.05 g/mol. IUPAC: 2-(1-methylimidazol-2-yl)sulfanyl-1-[2-(trifluoromethyl)phenothiazin-10-yl]ethanone.
Chemical Property Profile of BAS 01174036
Property Insights of BAS 01174036
The XLogP value of 5.3605 indicates that BAS 01174036 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.13 Ų, BAS 01174036 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01174036 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 BAS 01174036?
The CAS number of BAS 01174036 is 354991-87-0.
What is the molecular formula of BAS 01174036?
The molecular formula of BAS 01174036 is C19H14F3N3OS2.
What is the molecular weight of BAS 01174036?
The molecular weight of BAS 01174036 is 421.05 g/mol.
Where can I buy BAS 01174036?
You can request a quote for BAS 01174036 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01174036?
Yes, KEHONG BIO provides custom synthesis services for BAS 01174036 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.