F1838-3778
TL;DR: F1838-3778 (CAS 701229-55-2) is a chemical compound with molecular formula C21H21N5O3S2 and molecular weight 455.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[2-(4-acetamidoanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide
Also Known As: F1838-3778, N-[5-[2-(4-acetamidoanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide, N-(5-((2-((4-acetamidophenyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide, N-[5-({[(4-ACETAMIDOPHENYL)CARBAMOYL]METHYL}SULFANYL)-1,3,4-THIADIAZOL-2-YL]-3-PHENYLPROPANAMIDE, N-{5-[(2-{[4-(acetylamino)phenyl]amino}-2-oxoethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-phenylpropanamide
| Molecular Formula | C21H21N5O3S2 |
|---|---|
| Molecular Weight | 455.11 g/mol |
| LogP | 3.7986 |
| Topological Polar Surface Area | 113.08 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 455.10858 |
| Heavy Atoms | 31 |
| Complexity | 1038.6835 |
Chemical Identifiers
| CAS Number | 701229-55-2 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)NC(=O)CSC2=NN=C(S2)NC(=O)CCC3=CC=CC=C3 |
Product Overview
F1838-3778 (CAS 701229-55-2), with molecular formula C21H21N5O3S2 and molecular weight 455.11 g/mol. IUPAC: N-[5-[2-(4-acetamidoanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide.
Chemical Property Profile of F1838-3778
Property Insights of F1838-3778
The XLogP value of 3.7986 indicates that F1838-3778 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.08 Ų falls within the moderate polarity range, balancing permeability and solubility for F1838-3778. Following Lipinski's Rule of Five, F1838-3778 has 3 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 F1838-3778?
The CAS number of F1838-3778 is 701229-55-2.
What is the molecular formula of F1838-3778?
The molecular formula of F1838-3778 is C21H21N5O3S2.
What is the molecular weight of F1838-3778?
The molecular weight of F1838-3778 is 455.11 g/mol.
Where can I buy F1838-3778?
You can request a quote for F1838-3778 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1838-3778?
Yes, KEHONG BIO provides custom synthesis services for F1838-3778 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.