AB00433122-04
TL;DR: AB00433122-04 (CAS 847400-18-4) is a chemical compound with molecular formula C19H17N5O2S2 and molecular weight 411.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-methyl-5-[(2-oxo-1,3-benzothiazol-3-yl)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide
Also Known As: AB00433122-04, F0665-0022, 2-((4-methyl-5-((2-oxobenzo[d]thiazol-3(2H)-yl)methyl)-4H-1,2,4-triazol-3-yl)thio)-N-phenylacetamide, 2-({4-methyl-5-[(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-phenylacetamide, 2-[[4-methyl-5-[(2-oxo-1,3-benzothiazol-3-yl)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide
| Molecular Formula | C19H17N5O2S2 |
|---|---|
| Molecular Weight | 411.08 g/mol |
| LogP | 2.9706 |
| Topological Polar Surface Area | 81.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 411.08237 |
| Heavy Atoms | 28 |
| Complexity | 1179.9825 |
Chemical Identifiers
| CAS Number | 847400-18-4 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)NC2=CC=CC=C2)CN3C4=CC=CC=C4SC3=O |
Product Overview
AB00433122-04 (CAS 847400-18-4), with molecular formula C19H17N5O2S2 and molecular weight 411.08 g/mol. IUPAC: 2-[[4-methyl-5-[(2-oxo-1,3-benzothiazol-3-yl)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide.
Chemical Property Profile of AB00433122-04
Property Insights of AB00433122-04
The XLogP value of 2.9706 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00433122-04. The TPSA of 81.81 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00433122-04. Following Lipinski's Rule of Five, AB00433122-04 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 AB00433122-04?
The CAS number of AB00433122-04 is 847400-18-4.
What is the molecular formula of AB00433122-04?
The molecular formula of AB00433122-04 is C19H17N5O2S2.
What is the molecular weight of AB00433122-04?
The molecular weight of AB00433122-04 is 411.08 g/mol.
Where can I buy AB00433122-04?
You can request a quote for AB00433122-04 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00433122-04?
Yes, KEHONG BIO provides custom synthesis services for AB00433122-04 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.