4-(4-chlorophenyl)sulfonyl-N-(furan-2-ylmethyl)-2-[(E)-2-phenylethenyl]-1,3-oxazol-5-amine

Formula:C22H17N2O4ClS Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-(4-chlorophenyl)sulfonyl-N-(furan-2-ylmethyl)-2-[(E)-2-phenylethenyl]-1,3-oxazol-5-amine is a drug-like molecule.

MolName4-(4-chlorophenyl)sulfonyl-N-(furan-2-ylmethyl)-2-[(E)-2-phenylethenyl]-1,3-oxazol-5-amine
MolecularFormulaC22H17N2O4ClS
SmilesO=S(c1c(NCc2ccco2)oc(/C=C/c2ccccc2)n1)(c(cc1)ccc1Cl)=O
InChIInChI=1S/C22H17ClN2O4S/c23-17-9-11-19(12-10-17)30(26,27)22-21(24-15-18-7-4-14-28-18)29-20(25-22)13-8-16-5-2-1-3-6-16/h1-14,24H,15H2
InChIKWXXASRMGOGVXSO-UHFFFAOYSA-N
TotalMolweight440.906
Molweight440.906
MonoisotopicMass440.059755
CLogP4.3423
CLogS-6.11
H Acceptors6
H Donors1
TotalSurfaceArea326.4
Relative PSA0.24274
PolarSurfaceArea93.72
Druglikeness-0.58621
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.5
Fragments1
Non HAtoms30
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond7
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms22
Sp3Atoms2
Symmetricatoms5
Aromatic Nitrogens1
StereoCon

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