N-Nitroso-N-3-ethylindole-D-xylosylamine
TL;DR: N-Nitroso-N-3-ethylindole-D-xylosylamine (CAS 111858-66-3) is a chemical compound with molecular formula C15H19N3O5 and molecular weight 321.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(1H-indol-3-yl)ethyl]-N-[(3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]nitrous amide
Also Known As: N-Nitroso-N-3-ethylindole-D-xylosylamine, N-(2-(3-Indolyl)ethyl)-N-nitroso-D-xylopyranosylamine, D-Xylopyranosylamine, N-(2-(3-indolyl)ethyl)-N-nitroso-, D-Xylopyranosylamine, N-(2-(1H-indol-3-yl)ethyl)-N-nitroso-, D-Xylopyranosylamine, N-(2-(1H-indol-3-yl)ethyl)-N-nitroso- (9CI)
| Molecular Formula | C15H19N3O5 |
|---|---|
| Molecular Weight | 321.13 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 321.13248 |
| Heavy Atoms | 23 |
| Complexity | 413.0 |
Chemical Identifiers
| CAS Number | 111858-66-3 |
|---|---|
| SMILES | C1[C@H]([C@@H]([C@H](C(O1)N(CCC2=CNC3=CC=CC=C32)N=O)O)O)O |
| InChIKey | IHAFTOLIXGXSFD-PEUVFPKISA-N |
Product Overview
N-Nitroso-N-3-ethylindole-D-xylosylamine (CAS 111858-66-3), with molecular formula C15H19N3O5 and molecular weight 321.13 g/mol. IUPAC: N-[2-(1H-indol-3-yl)ethyl]-N-[(3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]nitrous amide.
Chemical Property Profile of N-Nitroso-N-3-ethylindole-D-xylosylamine
Property Insights of N-Nitroso-N-3-ethylindole-D-xylosylamine
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Nitroso-N-3-ethylindole-D-xylosylamine. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Nitroso-N-3-ethylindole-D-xylosylamine. Following Lipinski's Rule of Five, N-Nitroso-N-3-ethylindole-D-xylosylamine has 4 hydrogen bond donor(s) and 7 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-Nitroso-N-3-ethylindole-D-xylosylamine?
The CAS number of N-Nitroso-N-3-ethylindole-D-xylosylamine is 111858-66-3.
What is the molecular formula of N-Nitroso-N-3-ethylindole-D-xylosylamine?
The molecular formula of N-Nitroso-N-3-ethylindole-D-xylosylamine is C15H19N3O5.
What is the molecular weight of N-Nitroso-N-3-ethylindole-D-xylosylamine?
The molecular weight of N-Nitroso-N-3-ethylindole-D-xylosylamine is 321.13 g/mol.
Where can I buy N-Nitroso-N-3-ethylindole-D-xylosylamine?
You can request a quote for N-Nitroso-N-3-ethylindole-D-xylosylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Nitroso-N-3-ethylindole-D-xylosylamine?
Yes, KEHONG BIO provides custom synthesis services for N-Nitroso-N-3-ethylindole-D-xylosylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.