2-[(2E)-2-[(2-bromophenyl)methylidene]-3-oxo-1,4-benzoxazin-4-yl]-N-(3-morpholin-4-ylpropyl)acetamide

Formula:C24H26N3O4Br Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(2E)-2-[(2-bromophenyl)methylidene]-3-oxo-1,4-benzoxazin-4-yl]-N-(3-morpholin-4-ylpropyl)acetamide is not a drug-like molecule.

MolName	2-[(2E)-2-[(2-bromophenyl)methylidene]-3-oxo-1,4-benzoxazin-4-yl]-N-(3-morpholin-4-ylpropyl)acetamide
MolecularFormula	C24H26N3O4Br
Smiles	O=C(CN(c(cccc1)c1O/C1=C/c(cccc2)c2Br)C1=O)NCCCN1CCOCC1
InChI	InChI=1S/C24H26BrN3O4/c25-19-7-2-1-6-18(19)16-22-24(30)28(20-8-3-4-9-21(20)32-22)17-23(29)26-10-5-11-27-12-14-31-15-13-27/h1-4,6-9,16H,5,10-15,17H2,(H,26,29)
InChIK	PFGOUOAVLXPFGW-UHFFFAOYSA-N
TotalMolweight	500.391
Molweight	500.391
MonoisotopicMass	499.110668
CLogP	2.7963
CLogS	-4.137
H Acceptors	7
H Donors	1
TotalSurfaceArea	347
Relative PSA	0.18628
PolarSurfaceArea	71.11
Druglikeness	2.8012
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.5625
Fragments	1
Non HAtoms	32
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	7
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	11
Symmetricatoms	2
Amides	2
Amines	1
AlkylAmines	1
BasicNitrogens	1
StereoCon

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