Chemical ID: 6961060

CC(C)c1ccc(cc1)C(=O)Nc2cccc(c2)N3C(=O)c4ccccc4C3=O
Chemical ID:
6961060
Name [?]:
N-[3-(1,3-dioxoisoindolin-2-yl)phenyl]-4-isopropyl-benzamide
SMILES [?]:
CC(C)c1ccc(cc1)C(=O)Nc2cccc(c2)N3C(=O)c4ccccc4C3=O
InChi [?]:
InChI=1/C24H20N2O3/c1-15(2)16-10-12-17(13-11-16)22(27)25-18-6-5-7-19(14-18)26-23(28)20-8-3-4-9-21(20)24(26)29/h3-15H,1-2H3,(H,25,27)
InChi Info:
AuxInfo=1/1/N:1,3,24,25,15,14,16,23,26,5,9,6,8,18,2,4,7,13,17,22,27,10,20,28,12,19,11,21,29/E:(1,2)(3,4)(8,9)(10,11)(12,13)(20,21)(23,24)(28,29)/rA:29nCCCCCCCCCCONCCCCCCNCOCCCCCCCO/rB:s1;s2;s2;s4;d5;s6;d7;d4s8;s7;d10;s10;s12;s13;d14;s15;d16;d13s17;s17;s19;d20;s20;s22;d23;s24;d25;d22s26;s19s27;d28;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C24H20N2O3
All Atoms:49
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:12.3723
Area:607.95
Solvation:-2.82645
Coulombic:-50.5664
Bond Count [?]
All:32
Single:20
Double:12
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:384.427
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:5.08
LogP (Chemaxon):4.56

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