Xanthen-9-one, 3-chloro-4-(diethylamino)methyl-
TL;DR: Xanthen-9-one, 3-chloro-4-(diethylamino)methyl- (CAS 43159-87-1) is a chemical compound with molecular formula C18H18ClNO2 and molecular weight 315.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-4-(diethylaminomethyl)xanthen-9-one
Also Known As: 3-Chloro-4-(diethylamino)methylxanthen-9-one, Xanthen-9-one, 3-chloro-4-(diethylamino)methyl-, 3-chloro-4-(diethylaminomethyl)xanthen-9-one, 2-FURAMIDE,TETRAHYDRO-N-BENZYL-5-OXO-4-PHENYL, 3-CHLORO-4-[(DIETHYLAMINO)METHYL]-9H-XANTHEN-9-ONE
| Molecular Formula | C18H18ClNO2 |
|---|---|
| Molecular Weight | 315.10 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 315.1026 |
| Heavy Atoms | 22 |
| Complexity | 399.0 |
Chemical Identifiers
| CAS Number | 43159-87-1 |
|---|---|
| SMILES | CCN(CC)CC1=C(C=CC2=C1OC3=CC=CC=C3C2=O)Cl |
| InChIKey | LGMAIHUNBXLKBY-UHFFFAOYSA-N |
Product Overview
Xanthen-9-one, 3-chloro-4-(diethylamino)methyl- (CAS 43159-87-1), with molecular formula C18H18ClNO2 and molecular weight 315.10 g/mol. IUPAC: 3-chloro-4-(diethylaminomethyl)xanthen-9-one.
Chemical Property Profile of Xanthen-9-one, 3-chloro-4-(diethylamino)methyl-
Property Insights of Xanthen-9-one, 3-chloro-4-(diethylamino)methyl-
The XLogP value of 4.2 indicates that Xanthen-9-one, 3-chloro-4-(diethylamino)methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, Xanthen-9-one, 3-chloro-4-(diethylamino)methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Xanthen-9-one, 3-chloro-4-(diethylamino)methyl- has 0 hydrogen bond donor(s) and 3 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, 3-chloro-4-(diethylamino)methyl-?
The CAS number of Xanthen-9-one, 3-chloro-4-(diethylamino)methyl- is 43159-87-1.
What is the molecular formula of Xanthen-9-one, 3-chloro-4-(diethylamino)methyl-?
The molecular formula of Xanthen-9-one, 3-chloro-4-(diethylamino)methyl- is C18H18ClNO2.
What is the molecular weight of Xanthen-9-one, 3-chloro-4-(diethylamino)methyl-?
The molecular weight of Xanthen-9-one, 3-chloro-4-(diethylamino)methyl- is 315.10 g/mol.
Where can I buy Xanthen-9-one, 3-chloro-4-(diethylamino)methyl-?
You can request a quote for Xanthen-9-one, 3-chloro-4-(diethylamino)methyl- 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, 3-chloro-4-(diethylamino)methyl-?
Yes, KEHONG BIO provides custom synthesis services for Xanthen-9-one, 3-chloro-4-(diethylamino)methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.