pyrrolidin-1-yl(9H-xanthen-9-yl)methanone
TL;DR: pyrrolidin-1-yl(9H-xanthen-9-yl)methanone (CAS 101734-05-8) is a chemical compound with molecular formula C18H17NO2 and molecular weight 279.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pyrrolidin-1-yl(9H-xanthen-9-yl)methanone
Also Known As: pyrrolidin-1-yl(9H-xanthen-9-yl)methanone, pyrrolidinyl xanthen-9-yl ketone, 1-(9H-xanthen-9-ylcarbonyl)pyrrolidine, BAS 01130650, Pyrrolidin-1-yl-(9H-xanthen-9-yl)-methanone
| Molecular Formula | C18H17NO2 |
|---|---|
| Molecular Weight | 279.13 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 279.12592 |
| Heavy Atoms | 21 |
| Complexity | 369.0 |
Chemical Identifiers
| CAS Number | 101734-05-8 |
|---|---|
| SMILES | C1CCN(C1)C(=O)C2C3=CC=CC=C3OC4=CC=CC=C24 |
| InChIKey | IBPQONCUHONGQW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
pyrrolidin-1-yl(9H-xanthen-9-yl)methanone (CAS 101734-05-8), with molecular formula C18H17NO2 and molecular weight 279.13 g/mol. IUPAC: pyrrolidin-1-yl(9H-xanthen-9-yl)methanone.
Chemical Property Profile of pyrrolidin-1-yl(9H-xanthen-9-yl)methanone
Property Insights of pyrrolidin-1-yl(9H-xanthen-9-yl)methanone
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for pyrrolidin-1-yl(9H-xanthen-9-yl)methanone. With a topological polar surface area (TPSA) of 29.5 Ų, pyrrolidin-1-yl(9H-xanthen-9-yl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, pyrrolidin-1-yl(9H-xanthen-9-yl)methanone has 0 hydrogen bond donor(s) and 2 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 pyrrolidin-1-yl(9H-xanthen-9-yl)methanone?
The CAS number of pyrrolidin-1-yl(9H-xanthen-9-yl)methanone is 101734-05-8.
What is the molecular formula of pyrrolidin-1-yl(9H-xanthen-9-yl)methanone?
The molecular formula of pyrrolidin-1-yl(9H-xanthen-9-yl)methanone is C18H17NO2.
What is the molecular weight of pyrrolidin-1-yl(9H-xanthen-9-yl)methanone?
The molecular weight of pyrrolidin-1-yl(9H-xanthen-9-yl)methanone is 279.13 g/mol.
Where can I buy pyrrolidin-1-yl(9H-xanthen-9-yl)methanone?
You can request a quote for pyrrolidin-1-yl(9H-xanthen-9-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for pyrrolidin-1-yl(9H-xanthen-9-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for pyrrolidin-1-yl(9H-xanthen-9-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.