![2-[3-(benzyloxy)-2-hydroxypropyl]-1H-isoindole-1,3(2H)-dione structure](/static/products/905/90503-16-5.png)
2-[3-(benzyloxy)-2-hydroxypropyl]-1H-isoindole-1,3(2H)-dione
TL;DR: 2-[3-(benzyloxy)-2-hydroxypropyl]-1H-isoindole-1,3(2H)-dione (CAS 90503-16-5) is a chemical compound with molecular formula C18H17NO4 and molecular weight 311.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-hydroxy-3-phenylmethoxypropyl)isoindole-1,3-dione
Also Known As: 2-[3-(benzyloxy)-2-hydroxypropyl]-1H-isoindole-1,3(2H)-dione, 2-Benzyloxymethyl-2-hydroxy-1-phthalimido-ethane, 2-(2-hydroxy-3-phenylmethoxypropyl)isoindole-1,3-dione, 2-(3-(benzyloxy)-2-hydroxypropyl)isoindoline-1,3-dione, 2-(2-hydroxy-3-phenylmethoxy-propyl)isoindole-1,3-dione
| Molecular Formula | C18H17NO4 |
|---|---|
| Molecular Weight | 311.12 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 311.11575 |
| Heavy Atoms | 23 |
| Complexity | 409.0 |
Chemical Identifiers
| CAS Number | 90503-16-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)COCC(CN2C(=O)C3=CC=CC=C3C2=O)O |
| InChIKey | BQPGTZDMUJNXJZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-[3-(benzyloxy)-2-hydroxypropyl]-1H-isoindole-1,3(2H)-dione (CAS 90503-16-5), with molecular formula C18H17NO4 and molecular weight 311.12 g/mol. IUPAC: 2-(2-hydroxy-3-phenylmethoxypropyl)isoindole-1,3-dione.
Chemical Property Profile of 2-[3-(benzyloxy)-2-hydroxypropyl]-1H-isoindole-1,3(2H)-dione
Property Insights of 2-[3-(benzyloxy)-2-hydroxypropyl]-1H-isoindole-1,3(2H)-dione
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[3-(benzyloxy)-2-hydroxypropyl]-1H-isoindole-1,3(2H)-dione. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[3-(benzyloxy)-2-hydroxypropyl]-1H-isoindole-1,3(2H)-dione. Following Lipinski's Rule of Five, 2-[3-(benzyloxy)-2-hydroxypropyl]-1H-isoindole-1,3(2H)-dione has 1 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-[3-(benzyloxy)-2-hydroxypropyl]-1H-isoindole-1,3(2H)-dione?
The CAS number of 2-[3-(benzyloxy)-2-hydroxypropyl]-1H-isoindole-1,3(2H)-dione is 90503-16-5.
What is the molecular formula of 2-[3-(benzyloxy)-2-hydroxypropyl]-1H-isoindole-1,3(2H)-dione?
The molecular formula of 2-[3-(benzyloxy)-2-hydroxypropyl]-1H-isoindole-1,3(2H)-dione is C18H17NO4.
What is the molecular weight of 2-[3-(benzyloxy)-2-hydroxypropyl]-1H-isoindole-1,3(2H)-dione?
The molecular weight of 2-[3-(benzyloxy)-2-hydroxypropyl]-1H-isoindole-1,3(2H)-dione is 311.12 g/mol.
Where can I buy 2-[3-(benzyloxy)-2-hydroxypropyl]-1H-isoindole-1,3(2H)-dione?
You can request a quote for 2-[3-(benzyloxy)-2-hydroxypropyl]-1H-isoindole-1,3(2H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[3-(benzyloxy)-2-hydroxypropyl]-1H-isoindole-1,3(2H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-[3-(benzyloxy)-2-hydroxypropyl]-1H-isoindole-1,3(2H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.