F1285-0392
TL;DR: F1285-0392 (CAS 540772-34-7) is a chemical compound with molecular formula C18H19N5O4S2 and molecular weight 433.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[[2-[(3-tert-butyl-4-oxo-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]acetyl]amino]benzoate
Also Known As: F1285-0392, methyl 4-(2-((3-(tert-butyl)-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)thio)acetamido)benzoate, methyl 4-({[(3-tert-butyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]acetyl}amino)benzoate, methyl 4-[[2-[(3-tert-butyl-4-oxo-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]acetyl]amino]benzoate, METHYL 4-[2-({3-TERT-BUTYL-4-OXO-4H-[1,3,4]THIADIAZOLO[2,3-C][1,2,4]TRIAZIN-7-YL}SULFANYL)ACETAMIDO]BENZOATE
| Molecular Formula | C18H19N5O4S2 |
|---|---|
| Molecular Weight | 433.09 g/mol |
| LogP | 2.3609 |
| Topological Polar Surface Area | 115.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 433.08786 |
| Heavy Atoms | 29 |
| Complexity | 1115.9673 |
Chemical Identifiers
| CAS Number | 540772-34-7 |
|---|---|
| SMILES | CC(C)(C)C1=NN=C2N(C1=O)N=C(S2)SCC(=O)NC3=CC=C(C=C3)C(=O)OC |
Product Overview
F1285-0392 (CAS 540772-34-7), with molecular formula C18H19N5O4S2 and molecular weight 433.09 g/mol. IUPAC: methyl 4-[[2-[(3-tert-butyl-4-oxo-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]acetyl]amino]benzoate.
Chemical Property Profile of F1285-0392
Property Insights of F1285-0392
The XLogP value of 2.3609 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1285-0392. The TPSA of 115.55 Ų falls within the moderate polarity range, balancing permeability and solubility for F1285-0392. Following Lipinski's Rule of Five, F1285-0392 has 1 hydrogen bond donor(s) and 9 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 F1285-0392?
The CAS number of F1285-0392 is 540772-34-7.
What is the molecular formula of F1285-0392?
The molecular formula of F1285-0392 is C18H19N5O4S2.
What is the molecular weight of F1285-0392?
The molecular weight of F1285-0392 is 433.09 g/mol.
Where can I buy F1285-0392?
You can request a quote for F1285-0392 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1285-0392?
Yes, KEHONG BIO provides custom synthesis services for F1285-0392 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.