Chemical ID: 5909010

CCCC(=O)N(CC(=O)N(CCc1ccccc1)Cc2ccco2)C(C)C
Chemical ID:
5909010
Name [?]:
N-[(2-furylmethyl-phenethyl-carbamoyl)methyl]-N-isopropyl-butanamide
SMILES [?]:
CCCC(=O)N(CC(=O)N(CCc1ccccc1)Cc2ccco2)C(C)C
InChi [?]:
InChI=1/C22H30N2O3/c1-4-9-21(25)24(18(2)3)17-22(26)23(16-20-12-8-15-27-20)14-13-19-10-6-5-7-11-19/h5-8,10-12,15,18H,4,9,13-14,16-17H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,26,27,2,16,15,17,22,3,14,18,21,12,11,23,19,7,25,13,20,4,8,10,6,5,9,24/E:(2,3)(6,7)(10,11)/rA:27nCCCCONCCONCCCCCCCCCCCCCOCCC/rB:s1;s2;s3;d4;s4;s6;s7;d8;s8;s10;s11;s12;s13;d14;s15;d16;d13s17;s10;s19;d20;s21;d22;s20s23;s6;s25;s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H30N2O3
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:10.8284
Area:618.818
Solvation:-4.64206
Coulombic:-40.2923
Bond Count [?]
All:28
Single:21
Double:7
Rotors:12
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:370.485
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:3.15
LogP (Chemaxon):3.16

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Descriptor Annotations

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