N-[(Z)-[4-[(4-bromophenyl)methoxy]phenyl]methylideneamino]-4-(4-chlorophenyl)-1,3-thiazol-2-amine

Formula:C23H17N3OBrClS Mutagenic:none Tumorigenic:high Reproductive Effective:none N-[(Z)-[4-[(4-bromophenyl)methoxy]phenyl]methylideneamino]-4-(4-chlorophenyl)-1,3-thiazol-2-amine is not a drug-like molecule.

MolNameN-[(Z)-[4-[(4-bromophenyl)methoxy]phenyl]methylideneamino]-4-(4-chlorophenyl)-1,3-thiazol-2-amine
MolecularFormulaC23H17N3OBrClS
SmilesClc(cc1)ccc1-c1csc(N/N=C\c(cc2)ccc2OCc(cc2)ccc2Br)n1
InChIInChI=1S/C23H17BrClN3OS/c24-19-7-1-17(2-8-19)14-29-21-11-3-16(4-12-21)13-26-28-23-27-22(15-30-23)18-5-9-20(25)10-6-18/h1-13,15H,14H2,(H,27,28)
InChIKDQWQTRVTKMPCBB-UHFFFAOYSA-N
TotalMolweight498.831
Molweight498.831
MonoisotopicMass496.99642
CLogP8.8957
CLogS-7.571
H Acceptors4
H Donors1
TotalSurfaceArea341.27
Relative PSA0.18841
PolarSurfaceArea74.75
Druglikeness1.7613
Mutagenicnone
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functionsimine/hydrazone of aldehyde
Shape Index0.73333
Fragments1
Non HAtoms30
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond7
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms23
Sp3Atoms2
Symmetricatoms6
Aromatic Nitrogens1
BasicNitrogens1
StereoCon

Request More Details | N-[(Z)-[4-[(4-bromophenyl)methoxy]phenyl]methylideneamino]-4-(4-chlorophenyl)-1,3-thiazol-2-amine


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