Chemical ID: 5284697

CN(C)CCCN1C(c2c(=O)c3ccccc3oc2C1=O)c4ccc(cc4)OC
Chemical ID:
5284697
Name [?]:
None
SMILES [?]:
CN(C)CCCN1C(c2c(=O)c3ccccc3oc2C1=O)c4ccc(cc4)OC
InChi [?]:
InChI=1/C23H24N2O4/c1-24(2)13-6-14-25-20(15-9-11-16(28-3)12-10-15)19-21(26)17-7-4-5-8-18(17)29-22(19)23(25)27/h4-5,7-12,20H,6,13-14H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,3,29,14,15,5,13,16,23,27,24,26,4,6,22,25,12,17,9,8,10,19,20,2,7,11,21,28,18/E:(1,2)(9,10)(11,12)/rA:29cCNCCCCNCCCOCCCCCCOCCOCCCCCCOC/rB:s1;s2;s2;s4;s5;s6;s7;s8;s9;d10;s10;s12;d13;s14;d15;d12s16;s17;d9s18;s7s19;d20;s8;s22;d23;s24;d25;d22s26;s25;s28;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C23H24N2O4
All Atoms:29
Heavy Atoms:29
Chiral Atoms:1
ZAP Information [?]
Total:10.0081
Area:598.521
Solvation:-4.95497
Coulombic:-47.392
Bond Count [?]
All:32
Single:23
Double:9
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:392.448
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:2.55
LogP (Chemaxon):2.43

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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