Xanthen-9-one, 4-(diethylamino)methyl-3-nitro-
TL;DR: Xanthen-9-one, 4-(diethylamino)methyl-3-nitro- (CAS 43159-92-8) is a chemical compound with molecular formula C18H18N2O4 and molecular weight 326.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(diethylaminomethyl)-3-nitroxanthen-9-one
Also Known As: 4-(Diethylamino)methyl-3-nitroxanthen-9-one, Xanthen-9-one, 4-(diethylamino)methyl-3-nitro-, 4-(diethylaminomethyl)-3-nitroxanthen-9-one, 3-chloro-4-morpholin-4-ylmethyl-xanthen-9-one, 4-(Diethylamino)methyl-3-nitro-9H-xanthen-9-one
| Molecular Formula | C18H18N2O4 |
|---|---|
| Molecular Weight | 326.13 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 75.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 326.12665 |
| Heavy Atoms | 24 |
| Complexity | 474.0 |
Chemical Identifiers
| CAS Number | 43159-92-8 |
|---|---|
| SMILES | CCN(CC)CC1=C(C=CC2=C1OC3=CC=CC=C3C2=O)[N+](=O)[O-] |
| InChIKey | VDGYBMAXKRMNFH-UHFFFAOYSA-N |
Product Overview
Xanthen-9-one, 4-(diethylamino)methyl-3-nitro- (CAS 43159-92-8), with molecular formula C18H18N2O4 and molecular weight 326.13 g/mol. IUPAC: 4-(diethylaminomethyl)-3-nitroxanthen-9-one.
Chemical Property Profile of Xanthen-9-one, 4-(diethylamino)methyl-3-nitro-
Property Insights of Xanthen-9-one, 4-(diethylamino)methyl-3-nitro-
The XLogP value of 3.4 indicates that Xanthen-9-one, 4-(diethylamino)methyl-3-nitro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Xanthen-9-one, 4-(diethylamino)methyl-3-nitro-. Following Lipinski's Rule of Five, Xanthen-9-one, 4-(diethylamino)methyl-3-nitro- has 0 hydrogen bond donor(s) and 5 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 Xanthen-9-one, 4-(diethylamino)methyl-3-nitro-?
The CAS number of Xanthen-9-one, 4-(diethylamino)methyl-3-nitro- is 43159-92-8.
What is the molecular formula of Xanthen-9-one, 4-(diethylamino)methyl-3-nitro-?
The molecular formula of Xanthen-9-one, 4-(diethylamino)methyl-3-nitro- is C18H18N2O4.
What is the molecular weight of Xanthen-9-one, 4-(diethylamino)methyl-3-nitro-?
The molecular weight of Xanthen-9-one, 4-(diethylamino)methyl-3-nitro- is 326.13 g/mol.
Where can I buy Xanthen-9-one, 4-(diethylamino)methyl-3-nitro-?
You can request a quote for Xanthen-9-one, 4-(diethylamino)methyl-3-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Xanthen-9-one, 4-(diethylamino)methyl-3-nitro-?
Yes, KEHONG BIO provides custom synthesis services for Xanthen-9-one, 4-(diethylamino)methyl-3-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.