F1838-0076
TL;DR: F1838-0076 (CAS 868972-91-2) is a chemical compound with molecular formula C19H22N4O3S2 and molecular weight 418.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[2-(4-acetylanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]cyclohexanecarboxamide
Also Known As: F1838-0076, N-[5-({[(4-acetylphenyl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]cyclohexanecarboxamide, N-[5-[2-(4-acetylanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]cyclohexanecarboxamide, N-(5-((2-((4-acetylphenyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)cyclohexanecarboxamide
| Molecular Formula | C19H22N4O3S2 |
|---|---|
| Molecular Weight | 418.11 g/mol |
| LogP | 3.9903 |
| Topological Polar Surface Area | 101.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 418.11334 |
| Heavy Atoms | 28 |
| Complexity | 845.1186 |
Chemical Identifiers
| CAS Number | 868972-91-2 |
|---|---|
| SMILES | CC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(S2)NC(=O)C3CCCCC3 |
Product Overview
F1838-0076 (CAS 868972-91-2), with molecular formula C19H22N4O3S2 and molecular weight 418.11 g/mol. IUPAC: N-[5-[2-(4-acetylanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]cyclohexanecarboxamide.
Chemical Property Profile of F1838-0076
Property Insights of F1838-0076
The XLogP value of 3.9903 indicates that F1838-0076 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.05 Ų falls within the moderate polarity range, balancing permeability and solubility for F1838-0076. Following Lipinski's Rule of Five, F1838-0076 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 F1838-0076?
The CAS number of F1838-0076 is 868972-91-2.
What is the molecular formula of F1838-0076?
The molecular formula of F1838-0076 is C19H22N4O3S2.
What is the molecular weight of F1838-0076?
The molecular weight of F1838-0076 is 418.11 g/mol.
Where can I buy F1838-0076?
You can request a quote for F1838-0076 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1838-0076?
Yes, KEHONG BIO provides custom synthesis services for F1838-0076 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.