RefChem:234753
TL;DR: RefChem:234753 (CAS 98696-65-2) is a chemical compound with molecular formula C20H28N2O3 and molecular weight 344.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]-3-(1-methylpyrrol-2-yl)propan-1-one
Also Known As: 1-Propanone, 1-(2-(2-hydroxy-3-((1-methylethyl)amino)propoxy)phenyl)-3-(1-methyl-1H-pyrrol-2-yl)-, 1-[2-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]-3-(1-methylpyrrol-2-yl)propan-1-one, 1-(2-{2-Hydroxy-3-[(propan-2-yl)amino]propoxy}phenyl)-3-(1-methyl-1H-pyrrol-2-yl)propan-1-one, RefChem:234753
| Molecular Formula | C20H28N2O3 |
|---|---|
| Molecular Weight | 344.21 g/mol |
| LogP | 2.5783 |
| Topological Polar Surface Area | 63.49 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 344.21 |
| Heavy Atoms | 25 |
| Complexity | 679.0857 |
Chemical Identifiers
| CAS Number | 98696-65-2 |
|---|---|
| SMILES | CC(C)NCC(COC1=CC=CC=C1C(=O)CCC2=CC=CN2C)O |
Product Overview
RefChem:234753 (CAS 98696-65-2), with molecular formula C20H28N2O3 and molecular weight 344.21 g/mol. IUPAC: 1-[2-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]-3-(1-methylpyrrol-2-yl)propan-1-one.
Chemical Property Profile of RefChem:234753
Property Insights of RefChem:234753
The XLogP value of 2.5783 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:234753. The TPSA of 63.49 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:234753. Following Lipinski's Rule of Five, RefChem:234753 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 RefChem:234753?
The CAS number of RefChem:234753 is 98696-65-2.
What is the molecular formula of RefChem:234753?
The molecular formula of RefChem:234753 is C20H28N2O3.
What is the molecular weight of RefChem:234753?
The molecular weight of RefChem:234753 is 344.21 g/mol.
Where can I buy RefChem:234753?
You can request a quote for RefChem:234753 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:234753?
Yes, KEHONG BIO provides custom synthesis services for RefChem:234753 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.