2-(1H-benzimidazol-2-ylsulfanyl)-N-[(Z)-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)methylideneamino]acetamide

Formula:C23H22N6O2S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-(1H-benzimidazol-2-ylsulfanyl)-N-[(Z)-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)methylideneamino]acetamide is a drug-like molecule.

MolName	2-(1H-benzimidazol-2-ylsulfanyl)-N-[(Z)-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)methylideneamino]acetamide
MolecularFormula	C23H22N6O2S2
Smiles	O=C(CSc1nc(cccc2)c2[nH]1)N/N=C\c1c(-c2ccccc2)nc(N2CCOCC2)s1
InChI	InChI=1S/C23H22N6O2S2/c30-20(15-32-22-25-17-8-4-5-9-18(17)26-22)28-24-14-19-21(16-6-2-1-3-7-16)27-23(33-19)29-10-12-31-13-11-29/h1-9,14H,10-13,15H2,(H,25,26)(H,28,30)
InChIK	CIINDYQSCRIIBE-UHFFFAOYSA-N
TotalMolweight	478.6
Molweight	478.6
MonoisotopicMass	478.124564
CLogP	4.3828
CLogS	-5.967
H Acceptors	8
H Donors	2
TotalSurfaceArea	357.47
Relative PSA	0.34504
PolarSurfaceArea	149.04
Druglikeness	6.4096
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.54545
Fragments	1
Non HAtoms	33
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	7
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	20
Sp3Atoms	7
Symmetricatoms	4
Aromatic Nitrogens	3
BasicNitrogens	1
StereoCon

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1 - 2-(1H-benzimidazol-2-ylsulfanyl)-N-[(Z)-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)methylideneamino]acetamide | 2 - 2-(1H-benzimidazol-2-ylsulfanyl)-N-[(Z)-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)methylideneamino]acetamide

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