Chemical ID: 5214887

Cc1c2c(ncnc2on1)NCCCN(C)C
Chemical ID:
5214887
Name [?]:
N',N'-dimethyl-N-(9-methyl-7-oxa-3,5,8-triazabicyclo[4.3.0]nona-2,4,8,10-tetraen-2-yl)-propane-1,3-diamine
SMILES [?]:
Cc1c2c(ncnc2on1)NCCCN(C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C11H17N5O
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:8.2953
Area:434.809
Solvation:-2.57493
Coulombic:-31.3521
Bond Count [?]
All:18
Single:14
Double:4
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:235.286
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:1.26
LogP (Chemaxon):0.72

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