Chemical ID: 7080494

CC(C)c1ccc(cc1)C2c3c(=O)c4ccccc4oc3C(=O)N2CCCOC
Chemical ID:
7080494
Name [?]:
None
SMILES [?]:
CC(C)c1ccc(cc1)C2c3c(=O)c4ccccc4oc3C(=O)N2CCCOC
InChi [?]:
InChI=1/C24H25NO4/c1-15(2)16-9-11-17(12-10-16)21-20-22(26)18-7-4-5-8-19(18)29-23(20)24(27)25(21)13-6-14-28-3/h4-5,7-12,15,21H,6,13-14H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,3,29,16,17,26,15,18,5,9,6,8,25,27,2,4,7,14,19,11,10,12,21,22,24,13,23,28,20/E:(1,2)(9,10)(11,12)/rA:29cCCCCCCCCCCCCOCCCCCCOCCONCCCOC/rB:s1;s2;s2;s4;d5;s6;d7;d4s8;s7;s10;s11;d12;s12;s14;d15;s16;d17;d14s18;s19;d11s20;s21;d22;s10s22;s24;s25;s26;s27;s28;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C24H25NO4
All Atoms:54
Heavy Atoms:29
Chiral Atoms:1
ZAP Information [?]
Total:11.0468
Area:624.264
Solvation:-4.55978
Coulombic:-44.324
Bond Count [?]
All:32
Single:23
Double:9
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:391.46
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:3.99
LogP (Chemaxon):3.74

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Descriptor Annotations

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