Chemical ID: 5301810

CC(=O)NC1c2cc(ccc2N(C1=O)Cc3ccccc3)OC
Chemical ID:
5301810
Name [?]:
N-(1-benzyl-5-methoxy-2-oxo-indolin-3-yl)acetamide
SMILES [?]:
CC(=O)NC1c2cc(ccc2N(C1=O)Cc3ccccc3)OC
InChi [?]:
InChI=1/C18H18N2O3/c1-12(21)19-17-15-10-14(23-2)8-9-16(15)20(18(17)22)11-13-6-4-3-5-7-13/h3-10,17H,11H2,1-2H3,(H,19,21)
InChi Info:
AuxInfo=1/1/N:1,23,19,18,20,17,21,9,10,7,15,2,16,8,6,11,5,13,4,12,3,14,22/E:(4,5)(6,7)/rA:23cCCONCCCCCCCNCOCCCCCCCOC/rB:s1;d2;s2;s4;s5;s6;d7;s8;d9;d6s10;s11;s5s12;d13;s12;s15;s16;d17;s18;d19;d16s20;s8;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H18N2O3
All Atoms:23
Heavy Atoms:23
Chiral Atoms:1
ZAP Information [?]
Total:7.77043
Area:504.706
Solvation:-4.84721
Coulombic:-44.1978
Bond Count [?]
All:25
Single:17
Double:8
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:310.347
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:2.2
LogP (Chemaxon):1.51

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Descriptor Annotations

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