Chemical ID: 6924473

CCCCC(=O)Nc1ccc(cc1)C(=O)N(Cc2ccccc2)C(C)C
Chemical ID:
6924473
Name [?]:
N-benzyl-N-isopropyl-4-pentanoylamino-benzamide
SMILES [?]:
CCCCC(=O)Nc1ccc(cc1)C(=O)N(Cc2ccccc2)C(C)C
InChi [?]:
InChI=1/C22H28N2O2/c1-4-5-11-21(25)23-20-14-12-19(13-15-20)22(26)24(17(2)3)16-18-9-7-6-8-10-18/h6-10,12-15,17H,4-5,11,16H2,1-3H3,(H,23,25)
InChi Info:
AuxInfo=1/1/N:1,25,26,2,3,21,20,22,19,23,4,10,12,9,13,17,24,18,11,8,5,14,7,16,6,15/E:(2,3)(7,8)(9,10)(12,13)(14,15)/rA:26nCCCCCONCCCCCCCONCCCCCCCCCC/rB:s1;s2;s3;s4;d5;s5;s7;s8;d9;s10;d11;d8s12;s11;d14;s14;s16;s17;s18;d19;s20;d21;d18s22;s16;s24;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H28N2O2
All Atoms:54
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:11.9989
Area:595.4
Solvation:-2.88609
Coulombic:-40.027
Bond Count [?]
All:27
Single:19
Double:8
Rotors:10
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:352.47
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:4.81
LogP (Chemaxon):4.47

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