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446021-87-0 | N'-[2-(1H-1,2,3-Benzotriazol-1-yl)acetyl]-4-bromobenzohydrazide
CAS No: 446021-87-0 Catalog No: AG01F636 MDL No:
Product Description
Catalog Number:
AG01F636
Chemical Name:
N'-[2-(1H-1,2,3-Benzotriazol-1-yl)acetyl]-4-bromobenzohydrazide
CAS Number:
446021-87-0
Molecular Formula:
C15H12BrN5O2
Molecular Weight:
374.1921
IUPAC Name:
N'-[2-(benzotriazol-1-yl)acetyl]-4-bromobenzohydrazide
InChI:
InChI=1S/C15H12BrN5O2/c16-11-7-5-10(6-8-11)15(23)19-18-14(22)9-21-13-4-2-1-3-12(13)17-20-21/h1-8H,9H2,(H,18,22)(H,19,23)
InChI Key:
XGJYOHPFAQCGIA-UHFFFAOYSA-N
SMILES:
O=C(Cn1nnc2c1cccc2)NNC(=O)c1ccc(cc1)Br
Properties
Complexity:
442
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
373.017g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
374.198g/mol
Monoisotopic Mass:
373.017g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
88.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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