1H-Isoindol-1-one, 2,3-dihydro-2-(4-hydroxyphenyl)-
TL;DR: 1H-Isoindol-1-one, 2,3-dihydro-2-(4-hydroxyphenyl)- (CAS 4778-80-7) is a chemical compound with molecular formula C14H11NO2 and molecular weight 225.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-hydroxyphenyl)-3H-isoindol-1-one
Also Known As: 1-Aethyl-pyrrol-2-carbonsaeure, 2-(4-hydroxyphenyl)-3H-isoindol-1-one, NCI60_022109, 1H-Isoindol-1-one, 2,3-dihydro-2-(4-hydroxyphenyl)-, 1h-isoindol-1-one,2,3-dihydro-2-(4-hydroxyphenyl)-
| Molecular Formula | C14H11NO2 |
|---|---|
| Molecular Weight | 225.08 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 225.07898 |
| Heavy Atoms | 17 |
| Complexity | 297.0 |
Chemical Identifiers
| CAS Number | 4778-80-7 |
|---|---|
| SMILES | C1C2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)O |
| InChIKey | NDERTONLGOTDER-UHFFFAOYSA-N |
Product Overview
1H-Isoindol-1-one, 2,3-dihydro-2-(4-hydroxyphenyl)- (CAS 4778-80-7), with molecular formula C14H11NO2 and molecular weight 225.08 g/mol. IUPAC: 2-(4-hydroxyphenyl)-3H-isoindol-1-one.
Chemical Property Profile of 1H-Isoindol-1-one, 2,3-dihydro-2-(4-hydroxyphenyl)-
Property Insights of 1H-Isoindol-1-one, 2,3-dihydro-2-(4-hydroxyphenyl)-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Isoindol-1-one, 2,3-dihydro-2-(4-hydroxyphenyl)-. With a topological polar surface area (TPSA) of 40.5 Ų, 1H-Isoindol-1-one, 2,3-dihydro-2-(4-hydroxyphenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Isoindol-1-one, 2,3-dihydro-2-(4-hydroxyphenyl)- has 1 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 1H-Isoindol-1-one, 2,3-dihydro-2-(4-hydroxyphenyl)-?
The CAS number of 1H-Isoindol-1-one, 2,3-dihydro-2-(4-hydroxyphenyl)- is 4778-80-7.
What is the molecular formula of 1H-Isoindol-1-one, 2,3-dihydro-2-(4-hydroxyphenyl)-?
The molecular formula of 1H-Isoindol-1-one, 2,3-dihydro-2-(4-hydroxyphenyl)- is C14H11NO2.
What is the molecular weight of 1H-Isoindol-1-one, 2,3-dihydro-2-(4-hydroxyphenyl)-?
The molecular weight of 1H-Isoindol-1-one, 2,3-dihydro-2-(4-hydroxyphenyl)- is 225.08 g/mol.
Where can I buy 1H-Isoindol-1-one, 2,3-dihydro-2-(4-hydroxyphenyl)-?
You can request a quote for 1H-Isoindol-1-one, 2,3-dihydro-2-(4-hydroxyphenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Isoindol-1-one, 2,3-dihydro-2-(4-hydroxyphenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Isoindol-1-one, 2,3-dihydro-2-(4-hydroxyphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.