![methyl N-(17-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-18-yl)carbamate structure](/static/products/839/83935-77-7.png)
methyl N-(17-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-18-yl)carbamate
TL;DR: methyl N-(17-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-18-yl)carbamate (CAS 83935-77-7) is a chemical compound with molecular formula C16H22N2O9 and molecular weight 386.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-(18-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-17-yl)carbamate
Also Known As: methyl N-(17-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-18-yl)carbamate, methyl N-(17-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonade, Methoxy-N-(16-nitro(1,2,3,4,5,6,7,8,9,10,11,12,13-tridecahydrobenzo[a][15]annulen-15-yl))carboxamide, Methyl (16-nitro-2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecin-15-yl)carbamate
| Molecular Formula | C16H22N2O9 |
|---|---|
| Molecular Weight | 386.13 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 130.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 386.13254 |
| Heavy Atoms | 27 |
| Complexity | 460.0 |
Chemical Identifiers
| CAS Number | 83935-77-7 |
|---|---|
| SMILES | COC(=O)NC1=CC2=C(C=C1[N+](=O)[O-])OCCOCCOCCOCCO2 |
| InChIKey | MVWCEQYUVCEJIA-UHFFFAOYSA-N |
Product Overview
methyl N-(17-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-18-yl)carbamate (CAS 83935-77-7), with molecular formula C16H22N2O9 and molecular weight 386.13 g/mol. IUPAC: methyl N-(18-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-17-yl)carbamate.
Chemical Property Profile of methyl N-(17-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-18-yl)carbamate
Property Insights of methyl N-(17-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-18-yl)carbamate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-(17-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-18-yl)carbamate. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-(17-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-18-yl)carbamate. Following Lipinski's Rule of Five, methyl N-(17-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-18-yl)carbamate has 1 hydrogen bond donor(s) and 9 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 methyl N-(17-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-18-yl)carbamate?
The CAS number of methyl N-(17-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-18-yl)carbamate is 83935-77-7.
What is the molecular formula of methyl N-(17-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-18-yl)carbamate?
The molecular formula of methyl N-(17-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-18-yl)carbamate is C16H22N2O9.
What is the molecular weight of methyl N-(17-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-18-yl)carbamate?
The molecular weight of methyl N-(17-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-18-yl)carbamate is 386.13 g/mol.
Where can I buy methyl N-(17-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-18-yl)carbamate?
You can request a quote for methyl N-(17-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-18-yl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl N-(17-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-18-yl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for methyl N-(17-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-18-yl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.