AB00749428-01
TL;DR: AB00749428-01 (CAS 850348-67-3) is a chemical compound with molecular formula C13H16N4OS2 and molecular weight 308.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-methyl-N-[(4-methylphenyl)methyl]acetamide
Also Known As: AB00749428-01, 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-methyl-N-[(4-methylphenyl)methyl]acetamide, 2-[(5-Amino-1,3,4-thiadiazol-2-yl)thio]-N-methyl-N-[(4-methylphenyl)methyl]acetamide
| Molecular Formula | C13H16N4OS2 |
|---|---|
| Molecular Weight | 308.08 g/mol |
| LogP | 2.17942 |
| Topological Polar Surface Area | 72.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 308.07657 |
| Heavy Atoms | 20 |
| Complexity | 582.312 |
Chemical Identifiers
| CAS Number | 850348-67-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN(C)C(=O)CSC2=NN=C(S2)N |
Product Overview
AB00749428-01 (CAS 850348-67-3), with molecular formula C13H16N4OS2 and molecular weight 308.08 g/mol. IUPAC: 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-methyl-N-[(4-methylphenyl)methyl]acetamide.
Chemical Property Profile of AB00749428-01
Property Insights of AB00749428-01
The XLogP value of 2.17942 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00749428-01. The TPSA of 72.11 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00749428-01. Following Lipinski's Rule of Five, AB00749428-01 has 1 hydrogen bond donor(s) and 6 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 AB00749428-01?
The CAS number of AB00749428-01 is 850348-67-3.
What is the molecular formula of AB00749428-01?
The molecular formula of AB00749428-01 is C13H16N4OS2.
What is the molecular weight of AB00749428-01?
The molecular weight of AB00749428-01 is 308.08 g/mol.
Where can I buy AB00749428-01?
You can request a quote for AB00749428-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00749428-01?
Yes, KEHONG BIO provides custom synthesis services for AB00749428-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.