AB00751328-01
TL;DR: AB00751328-01 (CAS 879333-77-4) is a chemical compound with molecular formula C20H21FN4OS2 and molecular weight 416.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(2-fluoroanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(2-methyl-6-propan-2-ylphenyl)acetamide
Also Known As: AB00751328-01, 2-({5-[(2-fluorophenyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)-N-[2-methyl-6-(propan-2-yl)phenyl]acetamide, 2-{5-[(2-fluorophenyl)amino](1,3,4-thiadiazol-2-ylthio)}-N-[6-methyl-2-(methyl ethyl)phenyl]acetamide
| Molecular Formula | C20H21FN4OS2 |
|---|---|
| Molecular Weight | 416.11 g/mol |
| LogP | 5.58342 |
| Topological Polar Surface Area | 66.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 416.11407 |
| Heavy Atoms | 28 |
| Complexity | 974.3445 |
Chemical Identifiers
| CAS Number | 879333-77-4 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C(C)C)NC(=O)CSC2=NN=C(S2)NC3=CC=CC=C3F |
Product Overview
AB00751328-01 (CAS 879333-77-4), with molecular formula C20H21FN4OS2 and molecular weight 416.11 g/mol. IUPAC: 2-[[5-(2-fluoroanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(2-methyl-6-propan-2-ylphenyl)acetamide.
Chemical Property Profile of AB00751328-01
Property Insights of AB00751328-01
The XLogP value of 5.58342 indicates that AB00751328-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.91 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00751328-01. Following Lipinski's Rule of Five, AB00751328-01 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00751328-01?
The CAS number of AB00751328-01 is 879333-77-4.
What is the molecular formula of AB00751328-01?
The molecular formula of AB00751328-01 is C20H21FN4OS2.
What is the molecular weight of AB00751328-01?
The molecular weight of AB00751328-01 is 416.11 g/mol.
Where can I buy AB00751328-01?
You can request a quote for AB00751328-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00751328-01?
Yes, KEHONG BIO provides custom synthesis services for AB00751328-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.