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Chemical ID: 6036953
Chemical ID:
6036953
Name [?]:
N-[2-(2-furylmethylcarbamoyl)ethyl]-N-(3-methoxypropyl)furan-3-carboxamide
SMILES [?]:
COCCCN(CCC(=O)NCc1ccco1)C(=O)c2ccoc2
InChi [?]:
InChI=1/C17H22N2O5/c1-22-9-3-7-19(17(21)14-6-11-23-13-14)8-5-16(20)18-12-15-4-2-10-24-15/h2,4,6,10-11,13H,3,5,7-9,12H2,1H3,(H,18,20)
InChi Info:
AuxInfo=1/1/N:1,15,4,14,8,21,5,7,3,16,22,12,24,20,13,9,18,11,6,10,19,2,23,17/rA:24nCOCCCNCCCONCCCCCOCOCCCOC/rB:s1;s2;s3;s4;s5;s6;s7;s8;d9;s9;s11;s12;d13;s14;d15;s13s16;s6;d18;s18;s20;d21;s22;d20s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C17H22N2O5 |
All Atoms: | 24 |
Heavy Atoms: | 24 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 7.93097 |
Area: | 581.194 |
Solvation: | -6.59889 |
Coulombic: | -56.6016 |
Bond Count [?]
All: | 25 |
Single: | 19 |
Double: | 6 |
Rotors: | 12 |
Chiral: | 0 |
Rigid Segments: | 9 |
Chemical Properties
Molecular Weight: | 334.367 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 5 |
XLogP: | 0.08 |
LogP (Chemaxon): | 0.09 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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