Chemical ID: 5973471

c1ccc2c(c1)N(C(=O)CO2)Cc3ccc(o3)C(=O)NCc4ccco4
Chemical ID:
5973471
Name [?]:
N-(2-furylmethyl)-5-[(4-oxo-2-oxa-5-azabicyclo[4.4.0]deca-7,9,11-trien-5-yl)methyl]furan-2-carboxamide
SMILES [?]:
c1ccc2c(c1)N(C(=O)CO2)Cc3ccc(o3)C(=O)NCc4ccco4
InChi [?]:
InChI=1/C19H16N2O5/c22-18-12-25-16-6-2-1-5-15(16)21(18)11-14-7-8-17(26-14)19(23)20-10-13-4-3-9-24-13/h1-9H,10-12H2,(H,20,23)
InChi Info:
AuxInfo=1/1/N:1,2,24,23,6,3,14,15,25,21,12,10,22,13,5,4,16,8,18,20,7,9,19,26,11,17/rA:26nCCCCCCNCOCOCCCCCOCONCCCCCO/rB:s1;d2;s3;d4;d1s5;s5;s7;d8;s8;s4s10;s7;s12;d13;s14;d15;s13s16;s16;d18;s18;s20;s21;d22;s23;d24;s22s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H16N2O5
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:9.14531
Area:563.212
Solvation:-4.93498
Coulombic:-62.3471
Bond Count [?]
All:29
Single:20
Double:9
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:352.341
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:1.03
LogP (Chemaxon):0.71

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Descriptor Annotations

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