Chemical ID: 5169738

c1ccc2c(c1)cc3c(n2)-c4cccc5c4N(C3)CCC5
Chemical ID:
5169738
Name [?]:
None
SMILES [?]:
c1ccc2c(c1)cc3c(n2)-c4cccc5c4N(C3)CCC5
InChi [?]:
InChI=1/C19H16N2/c1-2-9-17-14(5-1)11-15-12-21-10-4-7-13-6-3-8-16(19(13)21)18(15)20-17/h1-3,5-6,8-9,11H,4,7,10,12H2
InChi Info:
AuxInfo=1/0/N:1,2,13,20,6,14,21,12,3,19,7,18,15,5,8,11,4,9,16,10,17/rA:21cCCCCCCCCCNCCCCCCNCCCC/rB:s1;d2;s3;s4;d1s5;d5;s7;d8;d4s9;s9;s11;d12;s13;d14;d11s15;s16;s8s17;s17;s19;s15s20;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H16N2
All Atoms:21
Heavy Atoms:21
Chiral Atoms:1
ZAP Information [?]
Total:8.90347
Area:433.13
Solvation:-1.92479
Coulombic:-14.0148
Bond Count [?]
All:25
Single:17
Double:8
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:272.344
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:4.26
LogP (Chemaxon):4.59

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