C592-1983
TL;DR: C592-1983 (CAS 476448-94-9) is a chemical compound with molecular formula C22H25N5O4S and molecular weight 455.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-ethyl-5-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-4-methoxybenzamide
Also Known As: C592-1983, F0528-0614, N-[[4-ethyl-5-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-4-methoxybenzamide, N-((4-ethyl-5-((2-((4-methoxyphenyl)amino)-2-oxoethyl)thio)-4H-1,2,4-triazol-3-yl)methyl)-4-methoxybenzamide, N-{[4-ETHYL-5-({[(4-METHOXYPHENYL)CARBAMOYL]METHYL}SULFANYL)-4H-1,2,4-TRIAZOL-3-YL]METHYL}-4-METHOXYBENZAMIDE
| Molecular Formula | C22H25N5O4S |
|---|---|
| Molecular Weight | 455.16 g/mol |
| LogP | 2.976 |
| Topological Polar Surface Area | 107.37 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 455.16272 |
| Heavy Atoms | 32 |
| Complexity | 1051.1881 |
Chemical Identifiers
| CAS Number | 476448-94-9 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)OC)CNC(=O)C3=CC=C(C=C3)OC |
Product Overview
C592-1983 (CAS 476448-94-9), with molecular formula C22H25N5O4S and molecular weight 455.16 g/mol. IUPAC: N-[[4-ethyl-5-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-4-methoxybenzamide.
Chemical Property Profile of C592-1983
Property Insights of C592-1983
The XLogP value of 2.976 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C592-1983. The TPSA of 107.37 Ų falls within the moderate polarity range, balancing permeability and solubility for C592-1983. Following Lipinski's Rule of Five, C592-1983 has 2 hydrogen bond donor(s) and 7 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 C592-1983?
The CAS number of C592-1983 is 476448-94-9.
What is the molecular formula of C592-1983?
The molecular formula of C592-1983 is C22H25N5O4S.
What is the molecular weight of C592-1983?
The molecular weight of C592-1983 is 455.16 g/mol.
Where can I buy C592-1983?
You can request a quote for C592-1983 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C592-1983?
Yes, KEHONG BIO provides custom synthesis services for C592-1983 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.