N-(4-acetamidophenyl)-2-[(5-butyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide
TL;DR: N-(4-acetamidophenyl)-2-[(5-butyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide (CAS 713098-60-3) is a chemical compound with molecular formula C25H28N6O2S and molecular weight 476.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-acetamidophenyl)-2-[(5-butyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide
Also Known As: N-(4-acetamidophenyl)-2-[(5-butyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide, N-[4-(acetylamino)phenyl]-2-[(5-butyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide, N~1~-[4-(ACETYLAMINO)PHENYL]-2-[(5-BUTYL-5H-[1,2,4]TRIAZINO[5,6-B]INDOL-3-YL)SULFANYL]BUTANAMIDE
| Molecular Formula | C25H28N6O2S |
|---|---|
| Molecular Weight | 476.20 g/mol |
| LogP | 5.2474 |
| Topological Polar Surface Area | 101.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 476.19943 |
| Heavy Atoms | 34 |
| Complexity | 1318.4927 |
Chemical Identifiers
| CAS Number | 713098-60-3 |
|---|---|
| SMILES | CCCCN1C2=CC=CC=C2C3=C1N=C(N=N3)SC(CC)C(=O)NC4=CC=C(C=C4)NC(=O)C |
Product Overview
N-(4-acetamidophenyl)-2-[(5-butyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide (CAS 713098-60-3), with molecular formula C25H28N6O2S and molecular weight 476.20 g/mol. IUPAC: N-(4-acetamidophenyl)-2-[(5-butyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide.
Chemical Property Profile of N-(4-acetamidophenyl)-2-[(5-butyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide
Property Insights of N-(4-acetamidophenyl)-2-[(5-butyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide
The XLogP value of 5.2474 indicates that N-(4-acetamidophenyl)-2-[(5-butyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.8 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-acetamidophenyl)-2-[(5-butyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide. Following Lipinski's Rule of Five, N-(4-acetamidophenyl)-2-[(5-butyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide 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 N-(4-acetamidophenyl)-2-[(5-butyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide?
The CAS number of N-(4-acetamidophenyl)-2-[(5-butyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide is 713098-60-3.
What is the molecular formula of N-(4-acetamidophenyl)-2-[(5-butyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide?
The molecular formula of N-(4-acetamidophenyl)-2-[(5-butyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide is C25H28N6O2S.
What is the molecular weight of N-(4-acetamidophenyl)-2-[(5-butyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide?
The molecular weight of N-(4-acetamidophenyl)-2-[(5-butyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide is 476.20 g/mol.
Where can I buy N-(4-acetamidophenyl)-2-[(5-butyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide?
You can request a quote for N-(4-acetamidophenyl)-2-[(5-butyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-acetamidophenyl)-2-[(5-butyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-acetamidophenyl)-2-[(5-butyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.