Chemical ID: 5998582

CCC(C)NC(=O)CN1CN(C2(C1=O)CCN(CC2)C(=O)c3ccc(cc3Cl)Cl)c4ccccc4
Chemical ID:
5998582
Name [?]:
2-[8-(2,4-dichlorobenzoyl)-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]dec-3-yl]-N-sec-butyl-acetamide
SMILES [?]:
CCC(C)NC(=O)CN1CN(C2(C1=O)CCN(CC2)C(=O)c3ccc(cc3Cl)Cl)c4ccccc4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C26H30Cl2N4O3
All Atoms:35
Heavy Atoms:35
Chiral Atoms:2
ZAP Information [?]
Total:13.9248
Area:735.999
Solvation:-4.47516
Coulombic:-63.9739
Bond Count [?]
All:38
Single:29
Double:9
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:517.447
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:4.78
LogP (Chemaxon):3.85

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