Chemical ID: 5232858

c1ccc2c(c1)CCC3N2C4c5ccccc5C(=O)N4CC3
Chemical ID:
5232858
Name [?]:
None
SMILES [?]:
c1ccc2c(c1)CCC3N2C4c5ccccc5C(=O)N4CC3
InChi [?]:
InChI=1/C19H18N2O/c22-19-16-7-3-2-6-15(16)18-20(19)12-11-14-10-9-13-5-1-4-8-17(13)21(14)18/h1-8,14,18H,9-12H2
InChi Info:
AuxInfo=1/0/N:1,14,15,2,6,13,16,3,7,8,22,21,5,9,12,17,4,11,18,20,10,19/rA:22cCCCCCCCCCNCCCCCCCCONCC/rB:s1;d2;s3;d4;d1s5;s5;s7;s8;s4s9;s10;s11;s12;d13;s14;d15;d12s16;s17;d18;s11s18;s20;s9s21;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H18N2O
All Atoms:22
Heavy Atoms:22
Chiral Atoms:3
ZAP Information [?]
Total:8.4839
Area:433.21
Solvation:-2.34634
Coulombic:-25.7178
Bond Count [?]
All:26
Single:19
Double:7
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:290.359
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:3.91
LogP (Chemaxon):3.71

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Experimental Annotations

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Descriptor Annotations

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