[(Z)-2-[(2-phenylacetyl)amino]ethylideneamino] N-naphthalen-1-ylcarbamate

Formula:C21H19N3O3 Mutagenic:high Tumorigenic:high Reproductive Effective:none [(Z)-2-[(2-phenylacetyl)amino]ethylideneamino] N-naphthalen-1-ylcarbamate is a drug-like molecule.

MolName[(Z)-2-[(2-phenylacetyl)amino]ethylideneamino] N-naphthalen-1-ylcarbamate
MolecularFormulaC21H19N3O3
SmilesO=C(Cc1ccccc1)NC/C=N\OC(Nc1cccc2ccccc12)=O
InChIInChI=1S/C21H19N3O3/c25-20(15-16-7-2-1-3-8-16)22-13-14-23-27-21(26)24-19-12-6-10-17-9-4-5-11-18(17)19/h1-12,14H,13,15H2,(H,22,25)(H,24,26)
InChIKQMDGCRCUHUKZEI-UHFFFAOYSA-N
TotalMolweight361.4
Molweight361.4
MonoisotopicMass361.142642
CLogP3.8773
CLogS-5.547
H Acceptors6
H Donors2
TotalSurfaceArea288.32
Relative PSA0.24455
PolarSurfaceArea79.79
Druglikeness-4.6294
Mutagenichigh
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.66667
Fragments1
Non HAtoms27
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond7
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms16
Sp3Atoms3
Symmetricatoms2
Amides2
StereoCon

Request More Details | [(Z)-2-[(2-phenylacetyl)amino]ethylideneamino] N-naphthalen-1-ylcarbamate


SKU Product Name Product Unit Qty Supplier Email
User Name
User Email
Additional Comments