Chemical ID: 6767916

CC1CC[NH+](CC1)CCCNC(=O)CN2c3cc(ccc3OCC2=O)C(C)(C)C
Chemical ID:
6767916
Name [?]:
N-[3-(4-methyl-3,4,5,6-tetrahydro-2H-pyridin-1-yl)propyl]-2-(9-oxo-3-tert-butyl-7-oxa-10-azabicyclo[4.4.0]deca-2,4,11-trien-10-yl)-acetamide
SMILES [?]:
CC1CC[NH+](CC1)CCCNC(=O)CN2c3cc(ccc3OCC2=O)C(C)(C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H36N3O3+
All Atoms:65
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:-17.5079
Area:649.819
Solvation:-33.7534
Coulombic:-17.0601
Bond Count [?]
All:31
Single:26
Double:5
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:402.55
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:3.37
LogP (Chemaxon):2.23

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