[(Z)-2-[(2-phenylacetyl)amino]ethylideneamino] N-(3,4-dichlorophenyl)carbamate

Formula:C17H15N3O3Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none [(Z)-2-[(2-phenylacetyl)amino]ethylideneamino] N-(3,4-dichlorophenyl)carbamate is a drug-like molecule.

MolName[(Z)-2-[(2-phenylacetyl)amino]ethylideneamino] N-(3,4-dichlorophenyl)carbamate
MolecularFormulaC17H15N3O3Cl2
SmilesO=C(Cc1ccccc1)NC/C=N\OC(Nc(cc1)cc(Cl)c1Cl)=O
InChIInChI=1S/C17H15Cl2N3O3/c18-14-7-6-13(11-15(14)19)22-17(24)25-21-9-8-20-16(23)10-12-4-2-1-3-5-12/h1-7,9,11H,8,10H2,(H,20,23)(H,22,24)
InChIKGBQHRVWDEJNVIG-UHFFFAOYSA-N
TotalMolweight380.23
Molweight380.23
MonoisotopicMass379.049046
CLogP3.8949
CLogS-5.413
H Acceptors6
H Donors2
TotalSurfaceArea284.56
Relative PSA0.24779
PolarSurfaceArea79.79
Druglikeness-4.561
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.72
Fragments1
Non HAtoms25
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond7
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms3
Symmetricatoms2
Amides2
StereoCon

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