ChemDiv1_022477
TL;DR: ChemDiv1_022477 (CAS 384348-89-4) is a chemical compound with molecular formula C17H20N2O4 and molecular weight 316.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,7-dimethyl-N-(4-nitrophenyl)-4-oxatricyclo[4.3.0.03,7]nonane-3-carboxamide
Also Known As: ChemDiv1_022477, 3a,6a-dimethyl-N-(4-nitrophenyl)hexahydro-1H-1,4-methanocyclopenta[c]furan-1-carboxamide, (6,7-dimethyl-9-oxatricyclo[4.3.0.0<3,7>]nonyl)-N-(4-nitrophenyl)carboxamide, 6,7-dimethyl-N-(4-nitrophenyl)-4-oxatricyclo[4.3.0.0~3,7~]nonane-3-carboxamide, Cambridge id 6957209
| Molecular Formula | C17H20N2O4 |
|---|---|
| Molecular Weight | 316.14 g/mol |
| LogP | 3.1286 |
| Topological Polar Surface Area | 81.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 316.1423 |
| Heavy Atoms | 23 |
| Complexity | 703.04987 |
Chemical Identifiers
| CAS Number | 384348-89-4 |
|---|---|
| SMILES | CC12CCC3C1(COC2(C3)C(=O)NC4=CC=C(C=C4)[N+](=O)[O-])C |
Product Overview
ChemDiv1_022477 (CAS 384348-89-4), with molecular formula C17H20N2O4 and molecular weight 316.14 g/mol. IUPAC: 6,7-dimethyl-N-(4-nitrophenyl)-4-oxatricyclo[4.3.0.03,7]nonane-3-carboxamide.
Chemical Property Profile of ChemDiv1_022477
Property Insights of ChemDiv1_022477
The XLogP value of 3.1286 indicates that ChemDiv1_022477 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.47 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_022477. Following Lipinski's Rule of Five, ChemDiv1_022477 has 1 hydrogen bond donor(s) and 4 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 ChemDiv1_022477?
The CAS number of ChemDiv1_022477 is 384348-89-4.
What is the molecular formula of ChemDiv1_022477?
The molecular formula of ChemDiv1_022477 is C17H20N2O4.
What is the molecular weight of ChemDiv1_022477?
The molecular weight of ChemDiv1_022477 is 316.14 g/mol.
Where can I buy ChemDiv1_022477?
You can request a quote for ChemDiv1_022477 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_022477?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_022477 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.