N-[2-(3-bromo-4-methoxyphenyl)-1,3-benzoxazol-5-yl]-4-ethoxybenzamide

Formula:C23H19N2O4Br Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[2-(3-bromo-4-methoxyphenyl)-1,3-benzoxazol-5-yl]-4-ethoxybenzamide is not a drug-like molecule.

MolName	N-[2-(3-bromo-4-methoxyphenyl)-1,3-benzoxazol-5-yl]-4-ethoxybenzamide
MolecularFormula	C23H19N2O4Br
Smiles	CCOc(cc1)ccc1C(Nc(cc1)cc2c1oc(-c(cc1)cc(Br)c1OC)n2)=O
InChI	InChI=1S/C23H19BrN2O4/c1-3-29-17-8-4-14(5-9-17)22(27)25-16-7-11-21-19(13-16)26-23(30-21)15-6-10-20(28-2)18(24)12-15/h4-13H,3H2,1-2H3,(H,25,27)
InChIK	SFEKCGCDOGBWNC-UHFFFAOYSA-N
TotalMolweight	467.318
Molweight	467.318
MonoisotopicMass	466.052819
CLogP	5.4534
CLogS	-7.288
H Acceptors	6
H Donors	1
TotalSurfaceArea	321.95
Relative PSA	0.21612
PolarSurfaceArea	73.59
Druglikeness	-2.1442
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.66667
Fragments	1
Non HAtoms	30
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	5
Symmetricatoms	2
Amides	1
Aromatic Nitrogens	1
StereoCon

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