(5E)-3-(2,4-dichlorophenyl)-5-[(1,3-diphenylpyrazol-4-yl)methylidene]-1,2-dihydro-1,2,4-triazin-6-one

Formula:C25H17N5OCl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (5E)-3-(2,4-dichlorophenyl)-5-[(1,3-diphenylpyrazol-4-yl)methylidene]-1,2-dihydro-1,2,4-triazin-6-one is a drug-like molecule.

MolName	(5E)-3-(2,4-dichlorophenyl)-5-[(1,3-diphenylpyrazol-4-yl)methylidene]-1,2-dihydro-1,2,4-triazin-6-one
MolecularFormula	C25H17N5OCl2
Smiles	O=C1NNC(c(ccc(Cl)c2)c2Cl)=N/C1=C/c1cn(-c2ccccc2)nc1-c1ccccc1
InChI	InChI=1S/C25H17Cl2N5O/c26-18-11-12-20(21(27)14-18)24-28-22(25(33)30-29-24)13-17-15-32(19-9-5-2-6-10-19)31-23(17)16-7-3-1-4-8-16/h1-15H,(H,28,29)(H,30,33)
InChIK	MFMXBIONDMQKFH-UHFFFAOYSA-N
TotalMolweight	474.35
Molweight	474.35
MonoisotopicMass	473.081014
CLogP	3.2796
CLogS	-7.005
H Acceptors	6
H Donors	2
TotalSurfaceArea	346.19
Relative PSA	0.18865
PolarSurfaceArea	71.31
Druglikeness	5.171
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.48485
Fragments	1
Non HAtoms	33
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	4
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	23
Symmetricatoms	4
Aromatic Nitrogens	2
BasicNitrogens	1
StereoCon

Click to Load Molecule:

1 - (5E)-3-(2,4-dichlorophenyl)-5-[(1,3-diphenylpyrazol-4-yl)methylidene]-1,2-dihydro-1,2,4-triazin-6-one | 2 - (5E)-3-(2,4-dichlorophenyl)-5-[(1,3-diphenylpyrazol-4-yl)methylidene]-1,2-dihydro-1,2,4-triazin-6-one

Request More Details | (5E)-3-(2,4-dichlorophenyl)-5-[(1,3-diphenylpyrazol-4-yl)methylidene]-1,2-dihydro-1,2,4-triazin-6-one

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments