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Home > Other Heterocycles > 870889-04-6
870889-04-6 | Urea, [8-(4-cyano-1-naphthalenyl)-8-azabicyclo[3.2.1]oct-3-yl]-
CAS No: 870889-04-6 Catalog No: AG004P7O MDL No:
Product Description
Catalog Number:
AG004P7O
Chemical Name:
Urea, [8-(4-cyano-1-naphthalenyl)-8-azabicyclo[3.2.1]oct-3-yl]-
CAS Number:
870889-04-6
Molecular Formula:
C19H20N4O
Molecular Weight:
320.3883
IUPAC Name:
[8-(4-cyanonaphthalen-1-yl)-8-azabicyclo[3.2.1]octan-3-yl]urea
InChI:
InChI=1S/C19H20N4O/c20-11-12-5-8-18(17-4-2-1-3-16(12)17)23-14-6-7-15(23)10-13(9-14)22-19(21)24/h1-5,8,13-15H,6-7,9-10H2,(H3,21,22,24)
InChI Key:
YGHGJWDNFFGJGR-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(c2c1cccc2)N1C2CCC1CC(C2)NC(=O)N
Properties
Complexity:
527
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
320.164g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
320.396g/mol
Monoisotopic Mass:
320.164g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
82.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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