NETGA
TL;DR: NETGA (CAS 121613-16-9) is a chemical compound with molecular formula C33H30N8O3 and molecular weight 586.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[[2-[4-(acridin-9-ylamino)anilino]-2-oxoethyl]carbamoyl]-1-methylpyrrol-3-yl]-4-amino-1-methylpyrrole-2-carboxamide
Also Known As: NETGA, Net GA, Netropsin-acridine hybrid ligand, N-[5-[[2-[4-(acridin-9-ylamino)anilino]-2-oxoethyl]carbamoyl]-1-methylpyrrol-3-yl]-4-amino-1-methylpyrrole-2-carboxamide, 4-(9-acridinylamino)-N-(4-(((4-amino-1-methylpyrrol-2-yl)carbonyl)amino)-1-methylpyrrol-2-carbonyl)g
| Molecular Formula | C33H30N8O3 |
|---|---|
| Molecular Weight | 586.24 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 148.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 586.2441 |
| Heavy Atoms | 44 |
| Complexity | 999.0 |
Chemical Identifiers
| CAS Number | 121613-16-9 |
|---|---|
| SMILES | CN1C=C(C=C1C(=O)NC2=CN(C(=C2)C(=O)NCC(=O)NC3=CC=C(C=C3)NC4=C5C=CC=CC5=NC6=CC=CC=C64)C)N |
| InChIKey | SAXKATHEPMBODZ-UHFFFAOYSA-N |
Product Overview
NETGA (CAS 121613-16-9), with molecular formula C33H30N8O3 and molecular weight 586.24 g/mol. IUPAC: N-[5-[[2-[4-(acridin-9-ylamino)anilino]-2-oxoethyl]carbamoyl]-1-methylpyrrol-3-yl]-4-amino-1-methylpyrrole-2-carboxamide.
Chemical Property Profile of NETGA
Property Insights of NETGA
The XLogP value of 3.6 indicates that NETGA is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 148.0 Ų indicates high polarity, suggesting NETGA may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, NETGA has 5 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 NETGA?
The CAS number of NETGA is 121613-16-9.
What is the molecular formula of NETGA?
The molecular formula of NETGA is C33H30N8O3.
What is the molecular weight of NETGA?
The molecular weight of NETGA is 586.24 g/mol.
Where can I buy NETGA?
You can request a quote for NETGA directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for NETGA?
Yes, KEHONG BIO provides custom synthesis services for NETGA and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.