Chemical ID: 6017029

CCCCC(=O)N(CCCOCC)CC(=O)N(Cc1ccc(cc1)F)Cc2ccco2
Chemical ID:
6017029
Name [?]:
N-(3-ethoxypropyl)-N-[[(4-fluorophenyl)methyl-(2-furylmethyl)carbamoyl]methyl]pentanamide
SMILES [?]:
CCCCC(=O)N(CCCOCC)CC(=O)N(Cc1ccc(cc1)F)Cc2ccco2
InChi [?]:
InChI=1/C24H33FN2O4/c1-3-5-9-23(28)26(14-7-15-30-4-2)19-24(29)27(18-22-8-6-16-31-22)17-20-10-12-21(25)13-11-20/h6,8,10-13,16H,3-5,7,9,14-15,17-19H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,13,2,12,3,29,9,28,4,20,24,21,23,8,10,30,18,26,14,19,22,27,5,15,25,7,17,6,16,11,31/E:(10,11)(12,13)/rA:31nCCCCCONCCCOCCCCONCCCCCCCFCCCCCO/rB:s1;s2;s3;s4;d5;s5;s7;s8;s9;s10;s11;s12;s7;s14;d15;s15;s17;s18;s19;d20;s21;d22;d19s23;s22;s17;s26;d27;s28;d29;s27s30;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C24H33FN2O4
All Atoms:31
Heavy Atoms:31
Chiral Atoms:0
ZAP Information [?]
Total:10.8689
Area:701.348
Solvation:-6.66482
Coulombic:-51.2362
Bond Count [?]
All:32
Single:25
Double:7
Rotors:16
Chiral:0
Rigid Segments:11
Chemical Properties
Molecular Weight:432.528
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:3.43
LogP (Chemaxon):2.92

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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