Chemical ID: 6016955

CCCCCC(=O)N(CCOC)CC(=O)N(Cc1ccc(cc1)F)Cc2ccco2
Chemical ID:
6016955
Name [?]:
N-[[(4-fluorophenyl)methyl-(2-furylmethyl)carbamoyl]methyl]-N-(2-methoxyethyl)hexanamide
SMILES [?]:
CCCCCC(=O)N(CCOC)CC(=O)N(Cc1ccc(cc1)F)Cc2ccco2
InChi [?]:
InChI=1/C23H31FN2O4/c1-3-4-5-8-22(27)25(13-15-29-2)18-23(28)26(17-21-7-6-14-30-21)16-19-9-11-20(24)12-10-19/h6-7,9-12,14H,3-5,8,13,15-18H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,12,2,3,4,28,27,5,19,23,20,22,9,29,10,17,25,13,18,21,26,6,14,24,8,16,7,15,11,30/E:(9,10)(11,12)/rA:30nCCCCCCONCCOCCCONCCCCCCCFCCCCCO/rB:s1;s2;s3;s4;s5;d6;s6;s8;s9;s10;s11;s8;s13;d14;s14;s16;s17;s18;d19;s20;d21;d18s22;s21;s16;s25;d26;s27;d28;s26s29;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C23H31FN2O4
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:9.91757
Area:677.102
Solvation:-7.00998
Coulombic:-51.0567
Bond Count [?]
All:31
Single:24
Double:7
Rotors:15
Chiral:0
Rigid Segments:10
Chemical Properties
Molecular Weight:418.502
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:3.21
LogP (Chemaxon):2.92

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Descriptor Annotations

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