furan-2-ylmethyl (Z)-2-[(3-bromobenzoyl)amino]-3-(4-chlorophenyl)prop-2-enoate

Formula:C21H15NO4BrCl Mutagenic:none Tumorigenic:none Reproductive Effective:none furan-2-ylmethyl (Z)-2-[(3-bromobenzoyl)amino]-3-(4-chlorophenyl)prop-2-enoate is not a drug-like molecule.

MolName	furan-2-ylmethyl (Z)-2-[(3-bromobenzoyl)amino]-3-(4-chlorophenyl)prop-2-enoate
MolecularFormula	C21H15NO4BrCl
Smiles	O=C(/C(/NC(c1cccc(Br)c1)=O)=C/c(cc1)ccc1Cl)OCc1ccco1
InChI	InChI=1S/C21H15BrClNO4/c22-16-4-1-3-15(12-16)20(25)24-19(11-14-6-8-17(23)9-7-14)21(26)28-13-18-5-2-10-27-18/h1-12H,13H2,(H,24,25)
InChIK	NJMYNKODLYUTLJ-UHFFFAOYSA-N
TotalMolweight	460.71
Molweight	460.71
MonoisotopicMass	458.987297
CLogP	5.1273
CLogS	-6.077
H Acceptors	5
H Donors	1
TotalSurfaceArea	311.95
Relative PSA	0.19763
PolarSurfaceArea	68.54
Druglikeness	0.51994
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.46429
Fragments	1
Non HAtoms	28
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	2
Symmetricatoms	2
Amides	1
StereoCon

Click to Load Molecule:

1 - furan-2-ylmethyl (Z)-2-[(3-bromobenzoyl)amino]-3-(4-chlorophenyl)prop-2-enoate | 2 - furan-2-ylmethyl (Z)-2-[(3-bromobenzoyl)amino]-3-(4-chlorophenyl)prop-2-enoate

Request More Details | furan-2-ylmethyl (Z)-2-[(3-bromobenzoyl)amino]-3-(4-chlorophenyl)prop-2-enoate

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments