N-[(Z)-furan-2-ylmethylideneamino]-4-(3-morpholin-4-ylsulfonylphenyl)-1,3-thiazol-2-amine

Formula:C18H18N4O4S2 Mutagenic:none Tumorigenic:high Reproductive Effective:none N-[(Z)-furan-2-ylmethylideneamino]-4-(3-morpholin-4-ylsulfonylphenyl)-1,3-thiazol-2-amine is a drug-like molecule.

MolNameN-[(Z)-furan-2-ylmethylideneamino]-4-(3-morpholin-4-ylsulfonylphenyl)-1,3-thiazol-2-amine
MolecularFormulaC18H18N4O4S2
SmilesO=S(c1cc(-c2csc(N/N=C\c3ccco3)n2)ccc1)(N1CCOCC1)=O
InChIInChI=1S/C18H18N4O4S2/c23-28(24,22-6-9-25-10-7-22)16-5-1-3-14(11-16)17-13-27-18(20-17)21-19-12-15-4-2-8-26-15/h1-5,8,11-13H,6-7,9-10H2,(H,20,21)
InChIKCPKCQDLLHVZCPI-UHFFFAOYSA-N
TotalMolweight418.497
Molweight418.497
MonoisotopicMass418.076946
CLogP4.4479
CLogS-3.548
H Acceptors8
H Donors1
TotalSurfaceArea303.81
Relative PSA0.36385
PolarSurfaceArea133.65
Druglikeness0.92534
Mutagenicnone
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functionsimine/hydrazone of aldehyde
Shape Index0.60714
Fragments1
Non HAtoms28
NonCHAtoms10
Electronegative Atoms10
Rotatable Bond5
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms16
Sp3Atoms6
Symmetricatoms3
Amides1
Aromatic Nitrogens1
BasicNitrogens1
StereoCon

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