COc1ccc2oc(Nc3ccc(Br)cc3)nc2c1
الاسم: N-(4-bromophenyl)-5-methoxy-1,3-benzoxazol-2-amine
SMILES: COc1ccc2oc(Nc3ccc(Br)cc3)nc2c1

Molecular Processing

Molecular formula
C14H11BrN2O2
Molecular weight
319.16
Exact mass
318.0004
XLogP
4.34
TPSA
47.29
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
19
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.071
Molar refractivity
77.99

Supplementary Information

InChIKey: GFKOBLYDSHLGSC-UHFFFAOYSA-N
مرادفات
SCHEMBL2893374GFKOBLYDSHLGSC-UHFFFAOYSA-N(4-bromo-phenyl)(5-methoxybenzoxazol-2-yl)amine(4-bromophenyl)(5-methoxybenzoxazol-2-yl)amine
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