5-chloro-N-[(Z)-[1-(2-fluorophenyl)pyrrol-2-yl]methylideneamino]-1-benzofuran-2-carboxamide

Formula:C20H13N3O2ClF Mutagenic:none Tumorigenic:none Reproductive Effective:high 5-chloro-N-[(Z)-[1-(2-fluorophenyl)pyrrol-2-yl]methylideneamino]-1-benzofuran-2-carboxamide is a drug-like molecule.

MolName	5-chloro-N-[(Z)-[1-(2-fluorophenyl)pyrrol-2-yl]methylideneamino]-1-benzofuran-2-carboxamide
MolecularFormula	C20H13N3O2ClF
Smiles	O=C(c1cc(cc(cc2)Cl)c2o1)N/N=C\c1cccn1-c(cccc1)c1F
InChI	InChI=1S/C20H13ClFN3O2/c21-14-7-8-18-13(10-14)11-19(27-18)20(26)24-23-12-15-4-3-9-25(15)17-6-2-1-5-16(17)22/h1-12H,(H,24,26)
InChIK	NBSOBVBCLRSMRA-UHFFFAOYSA-N
TotalMolweight	381.793
Molweight	381.793
MonoisotopicMass	381.068032
CLogP	4.6529
CLogS	-8.291
H Acceptors	5
H Donors	1
TotalSurfaceArea	282.01
Relative PSA	0.20209
PolarSurfaceArea	59.53
Druglikeness	4.1837
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.59259
Fragments	1
Non HAtoms	27
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	20
Aromatic Nitrogens	1
StereoCon

Click to Load Molecule:

1 - 5-chloro-N-[(Z)-[1-(2-fluorophenyl)pyrrol-2-yl]methylideneamino]-1-benzofuran-2-carboxamide | 2 - 5-chloro-N-[(Z)-[1-(2-fluorophenyl)pyrrol-2-yl]methylideneamino]-1-benzofuran-2-carboxamide

Request More Details | 5-chloro-N-[(Z)-[1-(2-fluorophenyl)pyrrol-2-yl]methylideneamino]-1-benzofuran-2-carboxamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments