C24H19N3O3 | Cheminformatics

2-(4-cyanophenoxy)-N-[(E)-(2-phenyl-2,3-dihydrochromen-4-ylidene)amino]acetamide

Formula:C24H19N3O3 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-(4-cyanophenoxy)-N-[(E)-(2-phenyl-2,3-dihydrochromen-4-ylidene)amino]acetamide is a drug-like molecule.

MolName2-(4-cyanophenoxy)-N-[(E)-(2-phenyl-2,3-dihydrochromen-4-ylidene)amino]acetamide
MolecularFormulaC24H19N3O3
SmilesN#Cc(cc1)ccc1OCC(N/N=C(\C1)/c(cccc2)c2OC1c1ccccc1)=O
InChIInChI=1S/C24H19N3O3/c25-15-17-10-12-19(13-11-17)29-16-24(28)27-26-21-14-23(18-6-2-1-3-7-18)30-22-9-5-4-8-20(21)22/h1-13,23H,14,16H2,(H,27,28)/t23-/m1/s1
InChIKADBNXVMCMFQURV-HSZRJFAPSA-N
TotalMolweight397.433
Molweight397.433
MonoisotopicMass397.142642
CLogP4.212
CLogS-5.862
H Acceptors6
H Donors1
TotalSurfaceArea313.19
Relative PSA0.22213
PolarSurfaceArea83.71
Druglikeness-0.77803
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone
Shape Index0.6
Fragments1
Non HAtoms30
NonCHAtoms6
Electronegative Atoms6
StereoCenters1
Rotatable Bond5
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms5
Symmetricatoms4
StereoConracemate

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