[4-[(Z)-[[2-[(3,4-dichlorobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] thiophene-2-carboxylate

Formula:C21H15N3O4Cl2S Mutagenic:none Tumorigenic:none Reproductive Effective:none [4-[(Z)-[[2-[(3,4-dichlorobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] thiophene-2-carboxylate is a drug-like molecule.

MolName	[4-[(Z)-[[2-[(3,4-dichlorobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] thiophene-2-carboxylate
MolecularFormula	C21H15N3O4Cl2S
Smiles	O=C(CNC(c(cc1)cc(Cl)c1Cl)=O)N/N=C\c(cc1)ccc1OC(c1cccs1)=O
InChI	InChI=1S/C21H15Cl2N3O4S/c22-16-8-5-14(10-17(16)23)20(28)24-12-19(27)26-25-11-13-3-6-15(7-4-13)30-21(29)18-2-1-9-31-18/h1-11H,12H2,(H,24,28)(H,26,27)
InChIK	KRXSNVCIZAVEAL-UHFFFAOYSA-N
TotalMolweight	476.339
Molweight	476.339
MonoisotopicMass	475.016031
CLogP	4.7944
CLogS	-6.44
H Acceptors	7
H Donors	2
TotalSurfaceArea	344.25
Relative PSA	0.30184
PolarSurfaceArea	125.1
Druglikeness	6.9594
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.67742
Fragments	1
Non HAtoms	31
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	8
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	2
Symmetricatoms	2
Amides	1
StereoCon

Click to Load Molecule:

1 - [4-[(Z)-[[2-[(3,4-dichlorobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] thiophene-2-carboxylate | 2 - [4-[(Z)-[[2-[(3,4-dichlorobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] thiophene-2-carboxylate

Request More Details | [4-[(Z)-[[2-[(3,4-dichlorobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] thiophene-2-carboxylate

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments