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124420-94-6 | Urea, N-(4-aminophenyl)-N'-4-pyridinyl-
CAS No: 124420-94-6 Catalog No: AG000LZ8 MDL No:
Product Description
Catalog Number:
AG000LZ8
Chemical Name:
Urea, N-(4-aminophenyl)-N'-4-pyridinyl-
CAS Number:
124420-94-6
Molecular Formula:
C12H12N4O
Molecular Weight:
228.2499
IUPAC Name:
1-(4-aminophenyl)-3-pyridin-4-ylurea
InChI:
InChI=1S/C12H12N4O/c13-9-1-3-10(4-2-9)15-12(17)16-11-5-7-14-8-6-11/h1-8H,13H2,(H2,14,15,16,17)
InChI Key:
LKBSTHUKWDQDQS-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccncc1)Nc1ccc(cc1)N
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.101g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
228.255g/mol
Monoisotopic Mass:
228.101g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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