(2R,3S)-2-benzoyl-3-(4-methoxyphenyl)cyclopropane-1,1-dicarbonitrile
TL;DR: (2R,3S)-2-benzoyl-3-(4-methoxyphenyl)cyclopropane-1,1-dicarbonitrile (CAS 652969-82-9) is a chemical compound with molecular formula C19H14N2O2 and molecular weight 302.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trans-(2R,3S)-2-benzoyl-3-(4-methoxyphenyl)cyclopropane-1,1-dicarbonitrile
Also Known As: J2.984.030J, (2R,3S)-2-benzoyl-3-(4-methoxyphenyl)cyclopropane-1,1-dicarbonitrile, 2alpha-Benzoyl-3beta-(4-methoxyphenyl)cyclopropane-1,1-dicarbonitrile
| Molecular Formula | C19H14N2O2 |
|---|---|
| Molecular Weight | 302.11 g/mol |
| LogP | 3.32506 |
| Topological Polar Surface Area | 73.88 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 302.10553 |
| Heavy Atoms | 23 |
| Complexity | 799.18835 |
Chemical Identifiers
| CAS Number | 652969-82-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)[C@@H]2[C@H](C2(C#N)C#N)C(=O)C3=CC=CC=C3 |
Product Overview
(2R,3S)-2-benzoyl-3-(4-methoxyphenyl)cyclopropane-1,1-dicarbonitrile (CAS 652969-82-9), with molecular formula C19H14N2O2 and molecular weight 302.11 g/mol. IUPAC: trans-(2R,3S)-2-benzoyl-3-(4-methoxyphenyl)cyclopropane-1,1-dicarbonitrile.
Chemical Property Profile of (2R,3S)-2-benzoyl-3-(4-methoxyphenyl)cyclopropane-1,1-dicarbonitrile
Property Insights of (2R,3S)-2-benzoyl-3-(4-methoxyphenyl)cyclopropane-1,1-dicarbonitrile
The XLogP value of 3.32506 indicates that (2R,3S)-2-benzoyl-3-(4-methoxyphenyl)cyclopropane-1,1-dicarbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.88 Ų falls within the moderate polarity range, balancing permeability and solubility for (2R,3S)-2-benzoyl-3-(4-methoxyphenyl)cyclopropane-1,1-dicarbonitrile. Following Lipinski's Rule of Five, (2R,3S)-2-benzoyl-3-(4-methoxyphenyl)cyclopropane-1,1-dicarbonitrile has 0 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 (2R,3S)-2-benzoyl-3-(4-methoxyphenyl)cyclopropane-1,1-dicarbonitrile?
The CAS number of (2R,3S)-2-benzoyl-3-(4-methoxyphenyl)cyclopropane-1,1-dicarbonitrile is 652969-82-9.
What is the molecular formula of (2R,3S)-2-benzoyl-3-(4-methoxyphenyl)cyclopropane-1,1-dicarbonitrile?
The molecular formula of (2R,3S)-2-benzoyl-3-(4-methoxyphenyl)cyclopropane-1,1-dicarbonitrile is C19H14N2O2.
What is the molecular weight of (2R,3S)-2-benzoyl-3-(4-methoxyphenyl)cyclopropane-1,1-dicarbonitrile?
The molecular weight of (2R,3S)-2-benzoyl-3-(4-methoxyphenyl)cyclopropane-1,1-dicarbonitrile is 302.11 g/mol.
Where can I buy (2R,3S)-2-benzoyl-3-(4-methoxyphenyl)cyclopropane-1,1-dicarbonitrile?
You can request a quote for (2R,3S)-2-benzoyl-3-(4-methoxyphenyl)cyclopropane-1,1-dicarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2R,3S)-2-benzoyl-3-(4-methoxyphenyl)cyclopropane-1,1-dicarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for (2R,3S)-2-benzoyl-3-(4-methoxyphenyl)cyclopropane-1,1-dicarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.