Chemical ID: 6282261

c1ccc(c(c1)c2nnc(o2)NC(=O)c3ccc(cc3)N4C(=O)CCC4=O)Cl
Chemical ID:
6282261
Name [?]:
N-[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]-4-(2,5-dioxopyrrolidin-1-yl)-benzamide
SMILES [?]:
c1ccc(c(c1)c2nnc(o2)NC(=O)c3ccc(cc3)N4C(=O)CCC4=O)Cl
InChi [?]:
InChI=1/C19H13ClN4O4/c20-14-4-2-1-3-13(14)18-22-23-19(28-18)21-17(27)11-5-7-12(8-6-11)24-15(25)9-10-16(24)26/h1-8H,9-10H2,(H,21,23,27)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,16,20,17,19,24,25,15,18,5,4,22,26,13,7,10,28,12,8,9,21,23,27,14,11/E:(5,6)(7,8)(9,10)(15,16)(25,26)/rA:28nCCCCCCCNNCONCOCCCCCCNCOCCCOCl/rB:s1;d2;s3;d4;d1s5;s5;d7;s8;d9;s7s10;s10;s12;d13;s13;s15;d16;s17;d18;d15s19;s18;s21;d22;s22;s24;s21s25;d26;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H13ClN4O4
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:9.93502
Area:598.613
Solvation:-5.0303
Coulombic:-58.929
Bond Count [?]
All:31
Single:20
Double:11
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:396.784
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:3.69
LogP (Chemaxon):2.19

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