Acetamide,N- -2-[ thio]-
TL;DR: Acetamide,N- -2-[ thio]- (CAS 603947-51-9) is a chemical compound with molecular formula C16H19N5O2S and molecular weight 345.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-tert-butyl-2-[(8-methoxy-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide
Also Known As: Acetamide,N- -2-[ thio]-, ASN 06018214, N-tert-Butyl-2-(6-methoxy-9H-1,3,4,9-tetraaza-fluoren-2-ylsulfanyl)-acetamide, N-tert-butyl-2-[(8-methoxy-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide, Acetamide, N-(1,1-dimethylethyl)-2-[(8-methoxy-2H-1,2,4-triazino[5,6-b]indol-3-yl)thio]- (9CI)
| Molecular Formula | C16H19N5O2S |
|---|---|
| Molecular Weight | 345.13 g/mol |
| LogP | 2.5215 |
| Topological Polar Surface Area | 92.79 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 345.12595 |
| Heavy Atoms | 24 |
| Complexity | 900.4958 |
Chemical Identifiers
| CAS Number | 603947-51-9 |
|---|---|
| SMILES | CC(C)(C)NC(=O)CSC1=NC2=C(C3=C(N2)C=CC(=C3)OC)N=N1 |
Product Overview
Acetamide,N- -2-[ thio]- (CAS 603947-51-9), with molecular formula C16H19N5O2S and molecular weight 345.13 g/mol. IUPAC: N-tert-butyl-2-[(8-methoxy-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide.
Chemical Property Profile of Acetamide,N- -2-[ thio]-
Property Insights of Acetamide,N- -2-[ thio]-
The XLogP value of 2.5215 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetamide,N- -2-[ thio]-. The TPSA of 92.79 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetamide,N- -2-[ thio]-. Following Lipinski's Rule of Five, Acetamide,N- -2-[ thio]- has 2 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 Acetamide,N- -2-[ thio]-?
The CAS number of Acetamide,N- -2-[ thio]- is 603947-51-9.
What is the molecular formula of Acetamide,N- -2-[ thio]-?
The molecular formula of Acetamide,N- -2-[ thio]- is C16H19N5O2S.
What is the molecular weight of Acetamide,N- -2-[ thio]-?
The molecular weight of Acetamide,N- -2-[ thio]- is 345.13 g/mol.
Where can I buy Acetamide,N- -2-[ thio]-?
You can request a quote for Acetamide,N- -2-[ thio]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetamide,N- -2-[ thio]-?
Yes, KEHONG BIO provides custom synthesis services for Acetamide,N- -2-[ thio]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.