[(E)-[amino-(4-chlorophenyl)methylidene]amino] N-[2-(2,3-dichlorophenyl)-1,3-thiazol-4-yl]carbamate

Formula:C17H11N4O2Cl3S Mutagenic:none Tumorigenic:none Reproductive Effective:none [(E)-[amino-(4-chlorophenyl)methylidene]amino] N-[2-(2,3-dichlorophenyl)-1,3-thiazol-4-yl]carbamate is not a drug-like molecule.

MolName[(E)-[amino-(4-chlorophenyl)methylidene]amino] N-[2-(2,3-dichlorophenyl)-1,3-thiazol-4-yl]carbamate
MolecularFormulaC17H11N4O2Cl3S
SmilesN/C(/c(cc1)ccc1Cl)=N/OC(Nc1csc(-c2cccc(Cl)c2Cl)n1)=O
InChIInChI=1S/C17H11Cl3N4O2S/c18-10-6-4-9(5-7-10)15(21)24-26-17(25)23-13-8-27-16(22-13)11-2-1-3-12(19)14(11)20/h1-8H,(H2,21,24)(H,23,25)
InChIKGJUFYJAAFPZRTI-UHFFFAOYSA-N
TotalMolweight441.725
Molweight441.725
MonoisotopicMass439.966827
CLogP5.8905
CLogS-7.112
H Acceptors6
H Donors2
TotalSurfaceArea304.44
Relative PSA0.3042
PolarSurfaceArea117.84
Druglikeness-3.7067
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.62963
Fragments1
Non HAtoms27
NonCHAtoms10
Electronegative Atoms10
Rotatable Bond5
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms17
Sp3Atoms1
Symmetricatoms2
Amides1
Aromatic Nitrogens1
StereoCon

Request More Details | [(E)-[amino-(4-chlorophenyl)methylidene]amino] N-[2-(2,3-dichlorophenyl)-1,3-thiazol-4-yl]carbamate


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