2-[[(E)-3-(2,4-dichlorophenyl)prop-2-enoyl]amino]benzoate

Formula:C16H10NO3Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[[(E)-3-(2,4-dichlorophenyl)prop-2-enoyl]amino]benzoate is a drug-like molecule.

MolName	2-[[(E)-3-(2,4-dichlorophenyl)prop-2-enoyl]amino]benzoate
MolecularFormula	C16H10NO3Cl2
Smiles	[O-]C(c(cccc1)c1NC(/C=C/c(ccc(Cl)c1)c1Cl)=O)=O
InChI	InChI=1S/C16H11Cl2NO3/c17-11-7-5-10(13(18)9-11)6-8-15(20)19-14-4-2-1-3-12(14)16(21)22/h1-9H,(H,19,20)(H,21,22)/p-1
InChIK	CTENGEUCBCFGAH-UHFFFAOYSA-M
TotalMolweight	335.165
Molweight	335.165
MonoisotopicMass	334.003773
CLogP	1.7574
CLogS	-4.983
H Acceptors	4
H Donors	1
TotalSurfaceArea	244.85
Relative PSA	0.21164
PolarSurfaceArea	69.23
Druglikeness	-0.18918
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.59091
Fragments	1
Non HAtoms	22
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	1
Amides	1
AcidicOxygens	1
StereoCon

Click to Load Molecule:

1 - 2-[[(E)-3-(2,4-dichlorophenyl)prop-2-enoyl]amino]benzoate | 2 - 2-[[(E)-3-(2,4-dichlorophenyl)prop-2-enoyl]amino]benzoate

Request More Details | 2-[[(E)-3-(2,4-dichlorophenyl)prop-2-enoyl]amino]benzoate

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments