Chemical ID: 6036974

c1cc(oc1)CNC(=O)CCN(Cc2ccc(cc2)F)C(=O)c3ccoc3
Chemical ID:
6036974
Name [?]:
N-[(4-fluorophenyl)methyl]-N-[2-(2-furylmethylcarbamoyl)ethyl]furan-3-carboxamide
SMILES [?]:
c1cc(oc1)CNC(=O)CCN(Cc2ccc(cc2)F)C(=O)c3ccoc3
InChi [?]:
InChI=1/C20H19FN2O4/c21-17-5-3-15(4-6-17)13-23(20(25)16-8-11-26-14-16)9-7-19(24)22-12-18-2-1-10-27-18/h1-6,8,10-11,14H,7,9,12-13H2,(H,22,24)
InChi Info:
AuxInfo=1/1/N:1,2,15,19,16,18,10,24,11,5,25,6,13,27,14,23,17,3,8,21,20,7,12,9,22,26,4/E:(3,4)(5,6)/rA:27nCCCOCCNCOCCNCCCCCCCFCOCCCOC/rB:s1;d2;s3;d1s4;s3;s6;s7;d8;s8;s10;s11;s12;s13;s14;d15;s16;d17;d14s18;s17;s12;d21;s21;s23;d24;s25;d23s26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H19FN2O4
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:8.77792
Area:587.191
Solvation:-5.90185
Coulombic:-54.091
Bond Count [?]
All:29
Single:20
Double:9
Rotors:10
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:370.374
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:1.78
LogP (Chemaxon):2.12

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Descriptor Annotations

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