Chemical ID: 7340572

CN(C)CCCNC(=O)c1cc2c3ccccc3[nH]c2c(n1)c4cc(ccc4OC)OC
Chemical ID:
7340572
Name [?]:
None
SMILES [?]:
CN(C)CCCNC(=O)c1cc2c3ccccc3[nH]c2c(n1)c4cc(ccc4OC)OC
InChi [?]:
InChI=1/C25H28N4O3/c1-29(2)13-7-12-26-25(30)21-15-18-17-8-5-6-9-20(17)27-23(18)24(28-21)19-14-16(31-3)10-11-22(19)32-4/h5-6,8-11,14-15,27H,7,12-13H2,1-4H3,(H,26,30)
InChi Info:
AuxInfo=1/1/N:1,3,32,30,15,16,5,14,17,26,27,6,4,24,11,25,13,12,23,18,10,28,20,21,8,7,19,22,2,9,31,29/E:(1,2)/rA:32nCNCCCCNCOCCCCCCCCCNCCNCCCCCCOCOC/rB:s1;s2;s2;s4;s5;s6;s7;d8;s8;s10;d11;s12;s13;d14;s15;d16;d13s17;s18;s12s19;d20;d10s21;s21;s23;d24;s25;d26;d23s27;s28;s29;s25;s31;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C25H28N4O3
All Atoms:60
Heavy Atoms:32
Chiral Atoms:0
ZAP Information [?]
Total:11.8766
Area:690.044
Solvation:-5.37453
Coulombic:-59.1694
Bond Count [?]
All:35
Single:25
Double:10
Rotors:9
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:432.515
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:3.84
LogP (Chemaxon):3.44

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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