(Z)-N-dimorpholin-4-ylphosphoryl-2,3-diphenyl-1,2,4-thiadiazol-5-imine

Formula:C22H26N5O3PS Mutagenic:high Tumorigenic:high Reproductive Effective:low (Z)-N-dimorpholin-4-ylphosphoryl-2,3-diphenyl-1,2,4-thiadiazol-5-imine is a drug-like molecule.

MolName(Z)-N-dimorpholin-4-ylphosphoryl-2,3-diphenyl-1,2,4-thiadiazol-5-imine
MolecularFormulaC22H26N5O3PS
SmilesO=P(N1CCOCC1)(N1CCOCC1)/N=C(/N=C1c2ccccc2)\SN1c1ccccc1
InChIInChI=1S/C22H26N5O3PS/c28-31(25-11-15-29-16-12-25,26-13-17-30-18-14-26)24-22-23-21(19-7-3-1-4-8-19)27(32-22)20-9-5-2-6-10-20/h1-10H,11-18H2
InChIKRBMHEKUGMXQFQZ-UHFFFAOYSA-N
TotalMolweight471.52
Molweight471.52
MonoisotopicMass471.149397
CLogP2.2901
CLogS-5.692
H Acceptors8
TotalSurfaceArea340.7
Relative PSA0.25882
PolarSurfaceArea105.08
Druglikeness-5.3524
Mutagenichigh
Tumorigenichigh
Reproductive Effectivelow
Irritantnone
Nasty Functions
Shape Index0.40625
Fragments1
Non HAtoms32
NonCHAtoms10
Electronegative Atoms10
Rotatable Bond2
Rings Closures5
Small Rings5
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms12
Symmetricatoms12
BasicNitrogens2
StereoCon

Request More Details | (Z)-N-dimorpholin-4-ylphosphoryl-2,3-diphenyl-1,2,4-thiadiazol-5-imine


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