Chemical ID: 7403325

Cc1ccccc1N2CCn3c2nc4c3c(=O)n(c(=O)n4C)CCc5ccccc5
Chemical ID:
7403325
Name [?]:
None
SMILES [?]:
Cc1ccccc1N2CCn3c2nc4c3c(=O)n(c(=O)n4C)CCc5ccccc5
InChi [?]:
InChI=1/C23H23N5O2/c1-16-8-6-7-11-18(16)26-14-15-27-19-20(24-22(26)27)25(2)23(30)28(21(19)29)13-12-17-9-4-3-5-10-17/h3-11H,12-15H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,22,28,27,29,4,5,3,26,30,6,24,23,9,10,2,25,7,15,14,16,12,19,13,21,8,11,18,17,20/E:(4,5)(9,10)/rA:30nCCCCCCCNCCNCNCCCONCONCCCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;s9;s10;s8s11;d12;s13;s11d14;s15;d16;s16;s18;d19;s14s19;s21;s18;s23;s24;s25;d26;s27;d28;d25s29;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C23H23N5O2
All Atoms:53
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:12.7907
Area:618.283
Solvation:-2.66637
Coulombic:-57.7749
Bond Count [?]
All:34
Single:24
Double:10
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:401.461
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:3.78
LogP (Chemaxon):5.14

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Descriptor Annotations

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