Chemical ID: 4169010

CC(=O)Nc1ccc2c(c1)C(=O)c3ccc(cc3C2=O)NC(=O)C
Chemical ID:
4169010
Name [?]:
N-(6-acetamido-9,10-dioxo-2-anthryl)acetamide
SMILES [?]:
CC(=O)Nc1ccc2c(c1)C(=O)c3ccc(cc3C2=O)NC(=O)C
InChi [?]:
InChI=1/C18H14N2O4/c1-9(21)19-11-3-5-13-15(7-11)17(23)14-6-4-12(20-10(2)22)8-16(14)18(13)24/h3-8H,1-2H3,(H,19,21)(H,20,22)
InChi Info:
AuxInfo=1/1/N:1,24,6,15,7,14,10,17,2,22,5,16,8,13,9,18,11,19,4,21,3,23,12,20/E:(1,2)(3,4)(5,6)(7,8)(9,10)(11,12)(13,14)(15,16)(17,18)(19,20)(21,22)(23,24)/gE:(1,2)/rA:24nCCONCCCCCCCOCCCCCCCONCOC/rB:s1;d2;s2;s4;s5;d6;s7;d8;d5s9;s9;d11;s11;s13;d14;s15;d16;d13s17;s8s18;d19;s16;s21;d22;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H14N2O4
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:7.81199
Area:508.126
Solvation:-4.89115
Coulombic:-53.6773
Bond Count [?]
All:26
Single:16
Double:10
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:322.315
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:1.19
LogP (Chemaxon):1.09

Name Annotations

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Descriptor Annotations

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