Chemical ID: 7429488

c1ccc2c(c1)CCN2C(=O)CN3c4ccccc4C(=O)C3=O
Chemical ID:
7429488
Name [?]:
1-(indolin-1-ylcarbonylmethyl)indoline-2,3-dione
SMILES [?]:
c1ccc2c(c1)CCN2C(=O)CN3c4ccccc4C(=O)C3=O
InChi [?]:
InChI=1/C18H14N2O3/c21-16(19-10-9-12-5-1-3-7-14(12)19)11-20-15-8-4-2-6-13(15)17(22)18(20)23/h1-8H,9-11H2
InChi Info:
AuxInfo=1/0/N:1,17,2,16,6,18,3,15,7,8,12,5,19,4,14,10,20,22,9,13,11,21,23/rA:23nCCCCCCCCNCOCNCCCCCCCOCO/rB:s1;d2;s3;d4;d1s5;s5;s7;s4s8;s9;d10;s10;s12;s13;s14;d15;s16;d17;d14s18;s19;d20;s13s20;d22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H14N2O3
All Atoms:37
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:8.46351
Area:488.035
Solvation:-3.73738
Coulombic:-43.4117
Bond Count [?]
All:26
Single:17
Double:9
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:306.315
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:1.45
LogP (Chemaxon):1.72

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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