Chemical ID: 3638203

CCOc1ccc(cc1)N(Cc2ccc(cc2)N(C)C)C(=O)c3ccco3
Chemical ID:
3638203
Name [?]:
N-[(4-dimethylaminophenyl)methyl]-N-(4-ethoxyphenyl)-furan-2-carboxamide
SMILES [?]:
CCOc1ccc(cc1)N(Cc2ccc(cc2)N(C)C)C(=O)c3ccco3
InChi [?]:
InChI=1/C22H24N2O3/c1-4-26-20-13-11-19(12-14-20)24(22(25)21-6-5-15-27-21)16-17-7-9-18(10-8-17)23(2)3/h5-15H,4,16H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,19,20,2,25,24,13,17,14,16,6,8,5,9,26,11,12,15,7,4,23,21,18,10,22,3,27/E:(2,3)(7,8)(9,10)(11,12)(13,14)/rA:27nCCOCCCCCCNCCCCCCCNCCCOCCCCO/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s7;s10;s11;s12;d13;s14;d15;d12s16;s15;s18;s18;s10;d21;s21;d23;s24;d25;s23s26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H24N2O3
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:10.5718
Area:580.503
Solvation:-3.94083
Coulombic:-40.7632
Bond Count [?]
All:29
Single:20
Double:9
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:364.438
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:4.09
LogP (Chemaxon):3.95

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Descriptor Annotations

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