J1.555.446K
TL;DR: J1.555.446K (CAS 189036-01-9) is a chemical compound with molecular formula C35H53N7O7 and molecular weight 683.40 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2S)-5-[[amino(nitramido)methylidene]amino]-1-[[(2S)-4-methyl-1-oxopentan-2-yl]amino]-1-oxopentan-2-yl]-2-cyclopentyl-10-(1,3-dioxoisoindol-2-yl)decanamide
Also Known As: J1.555.446K, 2H-Isoindole-2-decanamide, alpha-cyclopentyl-N-((1S)-1-((((1S)-1-formyl-3-methylbutyl)amino)carbonyl)-4-((imino(nitroamino)methyl)amino)butyl)-1,3-dihydro-1,3-dioxo-, Phthalimide-(CH2)8CH(cyclopentyl)CO-nitroarginyl-leucinal, Phthalimide-(CH2)8CH(cyclopentyl)CO-Arg(NO2)-Leu-H, 2H-Isoindole-2-decanamide, alpha-cyclopentyl-N-(1-(((1-formyl-3-methylbutyl)amino)carbonyl)-4-((imino(nitroamino)methyl)amino)butyl)-1,3-dihydro-1,3-dioxo-, (N(S(S)))-(partial)-
| Molecular Formula | C35H53N7O7 |
|---|---|
| Molecular Weight | 683.40 g/mol |
| LogP | 3.9105 |
| Topological Polar Surface Area | 206.2 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 22 |
| Exact Mass | 683.40063 |
| Heavy Atoms | 49 |
| Complexity | 1293.9019 |
Chemical Identifiers
| CAS Number | 189036-01-9 |
|---|---|
| SMILES | CC(C)C[C@@H](C=O)NC(=O)[C@H](CCCN=C(N)N[N+](=O)[O-])NC(=O)C(CCCCCCCCN1C(=O)C2=CC=CC=C2C1=O)C3CCCC3 |
Product Overview
J1.555.446K (CAS 189036-01-9), with molecular formula C35H53N7O7 and molecular weight 683.40 g/mol. IUPAC: N-[(2S)-5-[[amino(nitramido)methylidene]amino]-1-[[(2S)-4-methyl-1-oxopentan-2-yl]amino]-1-oxopentan-2-yl]-2-cyclopentyl-10-(1,3-dioxoisoindol-2-yl)decanamide.
Chemical Property Profile of J1.555.446K
Property Insights of J1.555.446K
The XLogP value of 3.9105 indicates that J1.555.446K is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 206.2 Ų indicates high polarity, suggesting J1.555.446K may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, J1.555.446K has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of J1.555.446K?
The CAS number of J1.555.446K is 189036-01-9.
What is the molecular formula of J1.555.446K?
The molecular formula of J1.555.446K is C35H53N7O7.
What is the molecular weight of J1.555.446K?
The molecular weight of J1.555.446K is 683.40 g/mol.
Where can I buy J1.555.446K?
You can request a quote for J1.555.446K directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for J1.555.446K?
Yes, KEHONG BIO provides custom synthesis services for J1.555.446K and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.