Chemical ID: 4279276

c1ccc2cc(ccc2c1)CN3CCc4c5ccccc5[nH]c4C3
Chemical ID:
4279276
Name [?]:
None
SMILES [?]:
c1ccc2cc(ccc2c1)CN3CCc4c5ccccc5[nH]c4C3
InChi [?]:
InChI=1/C22H20N2/c1-2-6-18-13-16(9-10-17(18)5-1)14-24-12-11-20-19-7-3-4-8-21(19)23-22(20)15-24/h1-10,13,23H,11-12,14-15H2
InChi Info:
AuxInfo=1/0/N:1,2,18,19,10,3,17,20,7,8,14,13,5,11,24,6,9,4,16,15,21,23,22,12/rA:24cCCCCCCCCCCCNCCCCCCCCCNCC/rB:s1;d2;s3;s4;d5;s6;d7;d4s8;d1s9;s6;s11;s12;s13;s14;s15;s16;d17;s18;d19;d16s20;s21;d15s22;s12s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H20N2
All Atoms:24
Heavy Atoms:24
Chiral Atoms:1
ZAP Information [?]
Total:10.6639
Area:513.009
Solvation:-2.16136
Coulombic:-18.9508
Bond Count [?]
All:28
Single:19
Double:9
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:312.408
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:4.68
LogP (Chemaxon):4.86

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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