N-[(Z)-(2,4-dichlorophenyl)methylideneamino]-5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-amine

Formula:C17H8N4Cl2F6 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-(2,4-dichlorophenyl)methylideneamino]-5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-amine is not a drug-like molecule.

MolNameN-[(Z)-(2,4-dichlorophenyl)methylideneamino]-5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-amine
MolecularFormulaC17H8N4Cl2F6
SmilesFC(c1c(ccc(N/N=C\c(ccc(Cl)c2)c2Cl)n2)c2nc(C(F)(F)F)c1)(F)F
InChIInChI=1S/C17H8Cl2F6N4/c18-9-2-1-8(12(19)5-9)7-26-29-14-4-3-10-11(16(20,21)22)6-13(17(23,24)25)27-15(10)28-14/h1-7H,(H,27,28,29)
InChIKQTCHJVIDFUENOZ-UHFFFAOYSA-N
TotalMolweight453.173
Molweight453.173
MonoisotopicMass452.003018
CLogP7.7529
CLogS-7.482
H Acceptors4
H Donors1
TotalSurfaceArea291.12
Relative PSA0.15427
PolarSurfaceArea50.17
Druglikeness-4.8055
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsimine/hydrazone of aldehyde
Shape Index0.51724
Fragments1
Non HAtoms29
NonCHAtoms12
Electronegative Atoms12
Rotatable Bond5
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms16
Sp3Atoms2
Symmetricatoms4
Aromatic Nitrogens2
BasicNitrogens1
StereoCon

Request More Details | N-[(Z)-(2,4-dichlorophenyl)methylideneamino]-5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-amine


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