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860651-42-9 | N'-[2-(1,2-benzoxazol-3-yl)acetyl]-4-methoxybenzohydrazide
CAS No: 860651-42-9 Catalog No: AG00IWC5 MDL No:MFCD04124403
Product Description
Catalog Number:
AG00IWC5
Chemical Name:
N'-[2-(1,2-benzoxazol-3-yl)acetyl]-4-methoxybenzohydrazide
CAS Number:
860651-42-9
Molecular Formula:
C17H15N3O4
Molecular Weight:
325.3187
MDL Number:
MFCD04124403
IUPAC Name:
N'-[2-(1,2-benzoxazol-3-yl)acetyl]-4-methoxybenzohydrazide
InChI:
InChI=1S/C17H15N3O4/c1-23-12-8-6-11(7-9-12)17(22)19-18-16(21)10-14-13-4-2-3-5-15(13)24-20-14/h2-9H,10H2,1H3,(H,18,21)(H,19,22)
InChI Key:
GKNVAKRKGDDWCA-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C(=O)NNC(=O)Cc1noc2c1cccc2
Properties
Complexity:
451
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.106g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
325.324g/mol
Monoisotopic Mass:
325.106g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
93.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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