Molecule

ID:83451

General Information
Structure
MolImage
Molecular Formula
C₂₃H₁₈ClNO₂
Molecular Mass
375.84752
Exact Mass
375.1026065
Charge
0
InChI
InChI=1S/C23H18ClNO2/c24-23(15-17-9-3-1-4-10-17)21(26)19-13-7-8-14-20(19)25(22(23)27)16-18-11-5-2-6-12-18/h1-14H,15-16H2
InChIKey
BPLQLJJOVFZZMU-UHFFFAOYSA-N
Canonic Smiles
O=C1N(Cc2ccccc2)c2ccccc2C(=O)C1(Cl)Cc1ccccc1
Isomeric Smiles
N1(C(=O)C(C(=O)c2ccccc12)(Cc1ccccc1)Cl)Cc1ccccc1
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
5.201243
LogD (pH = 7.4)
5.201243
Log P
5.201243
Molar Refractivity
106.4742
Polarizability
41.061806
Polar Surface Area
37.38
Rotatable Bonds
4
Lipinski's Rule of Five
false
Data Source
Names and Identifiers
Registration numbers
Properties
No Data Available
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Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
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References
Bioactivity
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