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Chemical ID: 4161581
Chemical ID:
4161581
Name [?]:
2-(2,3-dioxoindolin-1-yl)-N-(2-ethoxyphenyl)-acetamide
SMILES [?]:
CCOc1ccccc1NC(=O)CN2c3ccccc3C(=O)C2=O
InChi [?]:
InChI=1/C18H16N2O4/c1-2-24-15-10-6-4-8-13(15)19-16(21)11-20-14-9-5-3-7-12(14)17(22)18(20)23/h3-10H,2,11H2,1H3,(H,19,21)
InChi Info:
AuxInfo=1/1/N:1,2,18,7,17,6,19,8,16,5,13,20,9,15,4,11,21,23,10,14,12,22,24,3/rA:24nCCOCCCCCCNCOCNCCCCCCCOCO/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;s10;d11;s11;s13;s14;s15;d16;s17;d18;d15s19;s20;d21;s14s21;d23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C18H16N2O4 |
All Atoms: | 24 |
Heavy Atoms: | 24 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.5074 |
Area: | 528.232 |
Solvation: | -4.6984 |
Coulombic: | -55.7577 |
Bond Count [?]
All: | 26 |
Single: | 17 |
Double: | 9 |
Rotors: | 6 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 324.331 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 6 |
XLogP: | 1.8 |
LogP (Chemaxon): | 2.05 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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