N3Dhn79F8A
TL;DR: N3Dhn79F8A (CAS 1353746-57-2) is a chemical compound with molecular formula C14H9ClO2 and molecular weight 244.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R)-3-(4-chlorophenyl)-3H-2-benzofuran-1-one
Also Known As: J3.020.511A, (3R)-3-(4-Chlorophenyl)-1(3H)-isobenzofuranone, (3R)-3-(4-chlorophenyl)-3H-2-benzofuran-1-one, (R)-3alpha-(4-Chlorophenyl)isobenzofuran-1(3H)-one, 3-(4-Chlorophenyl)-1(3H)-isobenzofuranone, (3R)-
| Molecular Formula | C14H9ClO2 |
|---|---|
| Molecular Weight | 244.03 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 244.02911 |
| Heavy Atoms | 17 |
| Complexity | 297.0 |
Chemical Identifiers
| CAS Number | 1353746-57-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)[C@H](OC2=O)C3=CC=C(C=C3)Cl |
| InChIKey | SUSCNWIPCFTMMQ-CYBMUJFWSA-N |
Product Overview
N3Dhn79F8A (CAS 1353746-57-2), with molecular formula C14H9ClO2 and molecular weight 244.03 g/mol. IUPAC: (3R)-3-(4-chlorophenyl)-3H-2-benzofuran-1-one.
Chemical Property Profile of N3Dhn79F8A
Property Insights of N3Dhn79F8A
The XLogP value of 3.3 indicates that N3Dhn79F8A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, N3Dhn79F8A exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N3Dhn79F8A 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 N3Dhn79F8A?
The CAS number of N3Dhn79F8A is 1353746-57-2.
What is the molecular formula of N3Dhn79F8A?
The molecular formula of N3Dhn79F8A is C14H9ClO2.
What is the molecular weight of N3Dhn79F8A?
The molecular weight of N3Dhn79F8A is 244.03 g/mol.
Where can I buy N3Dhn79F8A?
You can request a quote for N3Dhn79F8A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N3Dhn79F8A?
Yes, KEHONG BIO provides custom synthesis services for N3Dhn79F8A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.