(+-)-2-(((1-(Hydroxymethyl)propyl)amino)methyl)-9H-xanthen-9-one hydrochloride
TL;DR: (+-)-2-(((1-(Hydroxymethyl)propyl)amino)methyl)-9H-xanthen-9-one hydrochloride (CAS 126929-77-9) is a chemical compound with molecular formula C18H20ClNO3 and molecular weight 333.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(1-hydroxybutan-2-ylamino)methyl]xanthen-9-one;hydrochloride
Also Known As: (+-)-2-(((1-(Hydroxymethyl)propyl)amino)methyl)-9H-xanthen-9-one hydrochloride, Chlorowodorek RS 2-N-(1'-hydroksybutylo-2'-amino)-metyloksantonu, Chlorowodorek RS 2-N-(1'-hydroksybutylo-2'-amino)-metyloksantonu [Polish], 9H-Xanthen-9-one, 2-(((1-(hydroxymethyl)propyl)amino)methyl)-, hydrochloride, (+-)-, 2-[(1-hydroxybutan-2-ylamino)methyl]xanthen-9-one hydrochloride
| Molecular Formula | C18H20ClNO3 |
|---|---|
| Molecular Weight | 333.11 g/mol |
| LogP | 3.2285 |
| Topological Polar Surface Area | 62.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 333.11316 |
| Heavy Atoms | 23 |
| Complexity | 855.62946 |
Chemical Identifiers
| CAS Number | 126929-77-9 |
|---|---|
| SMILES | CCC(CO)NCC1=CC2=C(C=C1)OC3=CC=CC=C3C2=O.Cl |
Product Overview
(+-)-2-(((1-(Hydroxymethyl)propyl)amino)methyl)-9H-xanthen-9-one hydrochloride (CAS 126929-77-9), with molecular formula C18H20ClNO3 and molecular weight 333.11 g/mol. IUPAC: 2-[(1-hydroxybutan-2-ylamino)methyl]xanthen-9-one;hydrochloride.
Chemical Property Profile of (+-)-2-(((1-(Hydroxymethyl)propyl)amino)methyl)-9H-xanthen-9-one hydrochloride
Property Insights of (+-)-2-(((1-(Hydroxymethyl)propyl)amino)methyl)-9H-xanthen-9-one hydrochloride
The XLogP value of 3.2285 indicates that (+-)-2-(((1-(Hydroxymethyl)propyl)amino)methyl)-9H-xanthen-9-one hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.47 Ų falls within the moderate polarity range, balancing permeability and solubility for (+-)-2-(((1-(Hydroxymethyl)propyl)amino)methyl)-9H-xanthen-9-one hydrochloride. Following Lipinski's Rule of Five, (+-)-2-(((1-(Hydroxymethyl)propyl)amino)methyl)-9H-xanthen-9-one hydrochloride has 2 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 (+-)-2-(((1-(Hydroxymethyl)propyl)amino)methyl)-9H-xanthen-9-one hydrochloride?
The CAS number of (+-)-2-(((1-(Hydroxymethyl)propyl)amino)methyl)-9H-xanthen-9-one hydrochloride is 126929-77-9.
What is the molecular formula of (+-)-2-(((1-(Hydroxymethyl)propyl)amino)methyl)-9H-xanthen-9-one hydrochloride?
The molecular formula of (+-)-2-(((1-(Hydroxymethyl)propyl)amino)methyl)-9H-xanthen-9-one hydrochloride is C18H20ClNO3.
What is the molecular weight of (+-)-2-(((1-(Hydroxymethyl)propyl)amino)methyl)-9H-xanthen-9-one hydrochloride?
The molecular weight of (+-)-2-(((1-(Hydroxymethyl)propyl)amino)methyl)-9H-xanthen-9-one hydrochloride is 333.11 g/mol.
Where can I buy (+-)-2-(((1-(Hydroxymethyl)propyl)amino)methyl)-9H-xanthen-9-one hydrochloride?
You can request a quote for (+-)-2-(((1-(Hydroxymethyl)propyl)amino)methyl)-9H-xanthen-9-one hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (+-)-2-(((1-(Hydroxymethyl)propyl)amino)methyl)-9H-xanthen-9-one hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for (+-)-2-(((1-(Hydroxymethyl)propyl)amino)methyl)-9H-xanthen-9-one hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.