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Home > Indoles and Oxindole > 708987-61-5
708987-61-5 | N-(1H-indol-5-yl)-5-methyl-3-phenyl-4-isoxazolecarboxamide
CAS No: 708987-61-5 Catalog No: AG01CAQH MDL No:MFCD03055810
Product Description
Catalog Number:
AG01CAQH
Chemical Name:
N-(1H-indol-5-yl)-5-methyl-3-phenyl-4-isoxazolecarboxamide
CAS Number:
708987-61-5
Molecular Formula:
C19H15N3O2
Molecular Weight:
317.3413
MDL Number:
MFCD03055810
IUPAC Name:
N-(1H-indol-5-yl)-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
InChI:
InChI=1S/C19H15N3O2/c1-12-17(18(22-24-12)13-5-3-2-4-6-13)19(23)21-15-7-8-16-14(11-15)9-10-20-16/h2-11,20H,1H3,(H,21,23)
InChI Key:
TZDXPFCHLMYIIN-UHFFFAOYSA-N
SMILES:
O=C(c1c(C)onc1c1ccccc1)Nc1ccc2c(c1)cc[nH]2
Properties
Complexity:
452
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.116g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
317.348g/mol
Monoisotopic Mass:
317.116g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
70.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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