Chemical ID: 6396216

c1cc(oc1)C(=O)NCCCCCCCCCCCCNC(=O)c2ccco2
Chemical ID:
6396216
Name [?]:
N-[12-(2-furylcarbonylamino)dodecyl]furan-2-carboxamide
SMILES [?]:
c1cc(oc1)C(=O)NCCCCCCCCCCCCNC(=O)c2ccco2
InChi [?]:
InChI=1/C22H32N2O4/c25-21(19-13-11-17-27-19)23-15-9-7-5-3-1-2-4-6-8-10-16-24-22(26)20-14-12-18-28-20/h11-14,17-18H,1-10,15-16H2,(H,23,25)(H,24,26)
InChi Info:
AuxInfo=1/1/N:14,15,13,16,12,17,11,18,10,19,1,26,2,25,9,20,5,27,3,24,6,22,8,21,7,23,4,28/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)(25,26)(27,28)/gE:(1,2)/rA:28nCCCOCCONCCCCCCCCCCCCNCOCCCCO/rB:s1;d2;s3;d1s4;s3;d6;s6;s8;s9;s10;s11;s12;s13;s14;s15;s16;s17;s18;s19;s20;s21;d22;s22;d24;s25;d26;s24s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H32N2O4
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:14.5733
Area:730.558
Solvation:-3.69065
Coulombic:-63.0369
Bond Count [?]
All:29
Single:23
Double:6
Rotors:17
Chiral:0
Rigid Segments:11
Chemical Properties
Molecular Weight:388.501
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:4.89
LogP (Chemaxon):3.28

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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