Chemical ID: 7616257

CC(CN1c2ccccc2Nc3c(cccn3)C1=O)N(C)C
Chemical ID:
7616257
Name [?]:
None
SMILES [?]:
CC(CN1c2ccccc2Nc3c(cccn3)C1=O)N(C)C
InChi [?]:
InChI=1/C17H20N4O/c1-12(20(2)3)11-21-15-9-5-4-8-14(15)19-16-13(17(21)22)7-6-10-18-16/h4-10,12H,11H2,1-3H3,(H,18,19)
InChi Info:
AuxInfo=1/1/N:1,21,22,8,7,15,14,9,6,16,3,2,13,10,5,12,18,17,11,20,4,19/E:(2,3)/rA:22cCCCNCCCCCCNCCCCCNCONCC/rB:s1;s2;s3;s4;s5;d6;s7;d8;d5s9;s10;s11;s12;d13;s14;d15;d12s16;s4s13;d18;s2;s20;s20;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H20N4O
All Atoms:42
Heavy Atoms:22
Chiral Atoms:None
ZAP Information [?]
Total:9.2929
Area:466.471
Solvation:-2.36888
Coulombic:-39.4916
Bond Count [?]
All:24
Single:17
Double:7
Rotors:3
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:2.49
LogP (Chemaxon):None

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