F0508-5313
TL;DR: F0508-5313 (CAS 389072-27-9) is a chemical compound with molecular formula C24H17F3N6O2S3 and molecular weight 574.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[5-[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]methyl]thiophene-2-carboxamide
Also Known As: F0508-5313, N-((5-((2-(benzo[d]thiazol-2-ylamino)-2-oxoethyl)thio)-4-(3-(trifluoromethyl)phenyl)-4H-1,2,4-triazol-3-yl)methyl)thiophene-2-carboxamide, N-[[5-[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]methyl]thiophene-2-carboxamide, N-{[5-({[(1,3-benzothiazol-2-yl)carbamoyl]methyl}sulfanyl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl]methyl}thiophene-2-carboxamide
| Molecular Formula | C24H17F3N6O2S3 |
|---|---|
| Molecular Weight | 574.05 g/mol |
| LogP | 5.6181 |
| Topological Polar Surface Area | 101.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 574.05273 |
| Heavy Atoms | 38 |
| Complexity | 1564.4943 |
Chemical Identifiers
| CAS Number | 389072-27-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)NC(=O)CSC3=NN=C(N3C4=CC=CC(=C4)C(F)(F)F)CNC(=O)C5=CC=CS5 |
Product Overview
F0508-5313 (CAS 389072-27-9), with molecular formula C24H17F3N6O2S3 and molecular weight 574.05 g/mol. IUPAC: N-[[5-[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]methyl]thiophene-2-carboxamide.
Chemical Property Profile of F0508-5313
Property Insights of F0508-5313
The XLogP value of 5.6181 indicates that F0508-5313 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.8 Ų falls within the moderate polarity range, balancing permeability and solubility for F0508-5313. Following Lipinski's Rule of Five, F0508-5313 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0508-5313?
The CAS number of F0508-5313 is 389072-27-9.
What is the molecular formula of F0508-5313?
The molecular formula of F0508-5313 is C24H17F3N6O2S3.
What is the molecular weight of F0508-5313?
The molecular weight of F0508-5313 is 574.05 g/mol.
Where can I buy F0508-5313?
You can request a quote for F0508-5313 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0508-5313?
Yes, KEHONG BIO provides custom synthesis services for F0508-5313 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.