Chemical ID: 5998075

c1ccc(cc1)N2CN(C(=O)C23CCN(CC3)C(=O)C45CC6CC(C4)CC(C6)C5)CC(=O)NCc7ccco7
Chemical ID:
5998075
Name [?]:
2-[8-(1-adamantylcarbonyl)-1-oxo-4-phenyl-2,4,8-triazaspiro[4.5]dec-2-yl]-N-(2-furylmethyl)acetamide
SMILES [?]:
c1ccc(cc1)N2CN(C(=O)C23CCN(CC3)C(=O)C45CC6CC(C4)CC(C6)C5)CC(=O)NCc7ccco7
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C31H38N4O4
All Atoms:39
Heavy Atoms:39
Chiral Atoms:1
ZAP Information [?]
Total:12.3039
Area:733.256
Solvation:-6.02746
Coulombic:-68.3925
Bond Count [?]
All:45
Single:37
Double:8
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:530.658
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:3.95
LogP (Chemaxon):3.11

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue