N-((4S)-4-Amino-5-((2-aminoethyl)amino)pentyl)-N'-nitroguanidine
TL;DR: N-((4S)-4-Amino-5-((2-aminoethyl)amino)pentyl)-N'-nitroguanidine (CAS 357965-98-1) is a chemical compound with molecular formula C8H21N7O2 and molecular weight 247.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4S)-4-amino-5-(2-aminoethylamino)pentyl]-1-nitroguanidine
Also Known As: NANT, nNOS Inhibitor I, JMC522060 Compound 2, HSCI1_000256, N-{(4S)-4-AMINO-5-[(2-AMINOETHYL)AMINO]PENTYL}-N'-NITROGUANIDINE
| Molecular Formula | C8H21N7O2 |
|---|---|
| Molecular Weight | 247.18 g/mol |
| LogP | -2.3 |
| Topological Polar Surface Area | 160.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 247.17567 |
| Heavy Atoms | 17 |
| Complexity | 241.0 |
Chemical Identifiers
| CAS Number | 357965-98-1 |
|---|---|
| SMILES | C(C[C@@H](CNCCN)N)CN=C(N)N[N+](=O)[O-] |
| InChIKey | RMSWBHUVFNFNIZ-ZETCQYMHSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-((4S)-4-Amino-5-((2-aminoethyl)amino)pentyl)-N'-nitroguanidine (CAS 357965-98-1), with molecular formula C8H21N7O2 and molecular weight 247.18 g/mol. IUPAC: 2-[(4S)-4-amino-5-(2-aminoethylamino)pentyl]-1-nitroguanidine.
Chemical Property Profile of N-((4S)-4-Amino-5-((2-aminoethyl)amino)pentyl)-N'-nitroguanidine
Property Insights of N-((4S)-4-Amino-5-((2-aminoethyl)amino)pentyl)-N'-nitroguanidine
The XLogP value of -2.3 indicates that N-((4S)-4-Amino-5-((2-aminoethyl)amino)pentyl)-N'-nitroguanidine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 160.0 Ų indicates high polarity, suggesting N-((4S)-4-Amino-5-((2-aminoethyl)amino)pentyl)-N'-nitroguanidine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-((4S)-4-Amino-5-((2-aminoethyl)amino)pentyl)-N'-nitroguanidine has 5 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 N-((4S)-4-Amino-5-((2-aminoethyl)amino)pentyl)-N'-nitroguanidine?
The CAS number of N-((4S)-4-Amino-5-((2-aminoethyl)amino)pentyl)-N'-nitroguanidine is 357965-98-1.
What is the molecular formula of N-((4S)-4-Amino-5-((2-aminoethyl)amino)pentyl)-N'-nitroguanidine?
The molecular formula of N-((4S)-4-Amino-5-((2-aminoethyl)amino)pentyl)-N'-nitroguanidine is C8H21N7O2.
What is the molecular weight of N-((4S)-4-Amino-5-((2-aminoethyl)amino)pentyl)-N'-nitroguanidine?
The molecular weight of N-((4S)-4-Amino-5-((2-aminoethyl)amino)pentyl)-N'-nitroguanidine is 247.18 g/mol.
Where can I buy N-((4S)-4-Amino-5-((2-aminoethyl)amino)pentyl)-N'-nitroguanidine?
You can request a quote for N-((4S)-4-Amino-5-((2-aminoethyl)amino)pentyl)-N'-nitroguanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-((4S)-4-Amino-5-((2-aminoethyl)amino)pentyl)-N'-nitroguanidine?
Yes, KEHONG BIO provides custom synthesis services for N-((4S)-4-Amino-5-((2-aminoethyl)amino)pentyl)-N'-nitroguanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.