(Z)-N-[3-[(4-chlorophenyl)methylsulfanyl]-5-propyl-1,2,4-triazol-4-yl]-1-(4-pentoxyphenyl)methanimine

Formula:C24H29N4OClS Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-N-[3-[(4-chlorophenyl)methylsulfanyl]-5-propyl-1,2,4-triazol-4-yl]-1-(4-pentoxyphenyl)methanimine is not a drug-like molecule.

MolName	(Z)-N-[3-[(4-chlorophenyl)methylsulfanyl]-5-propyl-1,2,4-triazol-4-yl]-1-(4-pentoxyphenyl)methanimine
MolecularFormula	C24H29N4OClS
Smiles	CCCCCOc1ccc(/C=N\n2c(SCc(cc3)ccc3Cl)nnc2CCC)cc1
InChI	InChI=1S/C24H29ClN4OS/c1-3-5-6-16-30-22-14-10-19(11-15-22)17-26-29-23(7-4-2)27-28-24(29)31-18-20-8-12-21(25)13-9-20/h8-15,17H,3-7,16,18H2,1-2H3
InChIK	RKVBZONGIHEAKZ-UHFFFAOYSA-N
TotalMolweight	457.04
Molweight	457.04
MonoisotopicMass	456.175058
CLogP	6.8407
CLogS	-8.429
H Acceptors	5
TotalSurfaceArea	368.01
Relative PSA	0.18426
PolarSurfaceArea	77.6
Druglikeness	-4.8686
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.67742
Fragments	1
Non HAtoms	31
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	12
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	11
Symmetricatoms	4
Aromatic Nitrogens	3
StereoCon

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1 - (Z)-N-[3-[(4-chlorophenyl)methylsulfanyl]-5-propyl-1,2,4-triazol-4-yl]-1-(4-pentoxyphenyl)methanimine | 2 - (Z)-N-[3-[(4-chlorophenyl)methylsulfanyl]-5-propyl-1,2,4-triazol-4-yl]-1-(4-pentoxyphenyl)methanimine

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