Chemical ID: 4613806

CC(C)N1c2ccccc2C(=NNC(=O)CNC(=O)c3ccccc3O)C1=O
Chemical ID:
4613806
Name [?]:
2-hydroxy-N-[(1-isopropyl-2-oxo-indolin-3-ylidene)aminocarbamoylmethyl]benzamide
SMILES [?]:
CC(C)N1c2ccccc2C(=NNC(=O)CNC(=O)c3ccccc3O)C1=O
InChi [?]:
InChI=1/C20H20N4O4/c1-12(2)24-15-9-5-3-7-13(15)18(20(24)28)23-22-17(26)11-21-19(27)14-8-4-6-10-16(14)25/h3-10,12,25H,11H2,1-2H3,(H,21,27)(H,22,26)
InChi Info:
AuxInfo=1/1/N:1,3,8,22,7,23,9,21,6,24,16,2,10,20,5,25,14,11,18,27,17,13,12,4,26,15,19,28/E:(1,2)/rA:28nCCCNCCCCCCCNNCOCNCOCCCCCCOCO/rB:s1;s2;s2;s4;s5;d6;s7;d8;d5s9;s10;w11;s12;s13;d14;s14;s16;s17;d18;s18;s20;d21;s22;d23;d20s24;s25;s4s11;d27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H20N4O4
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:9.40264
Area:611.583
Solvation:-5.88693
Coulombic:-73.9573
Bond Count [?]
All:30
Single:20
Double:10
Rotors:7
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:380.397
H-Bond Donors:3
H-Bond Acceptors:8
XLogP:3.08
LogP (Chemaxon):2.45

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