F0334-5452
TL;DR: F0334-5452 (CAS 392247-53-9) is a chemical compound with molecular formula C20H20ClN5O4S2 and molecular weight 493.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(2-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]-4-morpholin-4-ylsulfonylbenzamide
Also Known As: F0334-5452, N-((4-(2-chlorophenyl)-5-mercapto-4H-1,2,4-triazol-3-yl)methyl)-4-(morpholinosulfonyl)benzamide, N-[[4-(2-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]-4-morpholin-4-ylsulfonylbenzamide, N-{[4-(2-chlorophenyl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]methyl}-4-(morpholine-4-sulfonyl)benzamide, N-{[4-(2-CHLOROPHENYL)-5-SULFANYLIDENE-4,5-DIHYDRO-1H-1,2,4-TRIAZOL-3-YL]METHYL}-4-(MORPHOLINE-4-SULFONYL)BENZAMIDE
| Molecular Formula | C20H20ClN5O4S2 |
|---|---|
| Molecular Weight | 493.06 g/mol |
| LogP | 2.53419 |
| Topological Polar Surface Area | 109.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 493.0645 |
| Heavy Atoms | 32 |
| Complexity | 1281.819 |
Chemical Identifiers
| CAS Number | 392247-53-9 |
|---|---|
| SMILES | C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC3=NNC(=S)N3C4=CC=CC=C4Cl |
Product Overview
F0334-5452 (CAS 392247-53-9), with molecular formula C20H20ClN5O4S2 and molecular weight 493.06 g/mol. IUPAC: N-[[4-(2-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]-4-morpholin-4-ylsulfonylbenzamide.
Chemical Property Profile of F0334-5452
Property Insights of F0334-5452
The XLogP value of 2.53419 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0334-5452. The TPSA of 109.32 Ų falls within the moderate polarity range, balancing permeability and solubility for F0334-5452. Following Lipinski's Rule of Five, F0334-5452 has 2 hydrogen bond donor(s) and 6 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 F0334-5452?
The CAS number of F0334-5452 is 392247-53-9.
What is the molecular formula of F0334-5452?
The molecular formula of F0334-5452 is C20H20ClN5O4S2.
What is the molecular weight of F0334-5452?
The molecular weight of F0334-5452 is 493.06 g/mol.
Where can I buy F0334-5452?
You can request a quote for F0334-5452 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0334-5452?
Yes, KEHONG BIO provides custom synthesis services for F0334-5452 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.