Chemical ID: 5999704

CCCCN(CC(=O)N1CC(=O)N(C1)c2ccc(cc2)Cl)C(=O)C3CCC3
Chemical ID:
5999704
Name [?]:
N-butyl-N-[[3-(4-chlorophenyl)-4-oxo-imidazolidin-1-yl]carbonylmethyl]cyclobutanecarboxamide
SMILES [?]:
CCCCN(CC(=O)N1CC(=O)N(C1)c2ccc(cc2)Cl)C(=O)C3CCC3
InChi [?]:
InChI=1/C20H26ClN3O3/c1-2-3-11-22(20(27)15-5-4-6-15)12-18(25)23-13-19(26)24(14-23)17-9-7-16(21)8-10-17/h7-10,15H,2-6,11-14H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,3,26,25,27,17,19,16,20,4,6,10,14,24,18,15,7,11,22,21,5,9,13,8,12,23/E:(5,6)(7,8)(9,10)/rA:27nCCCCNCCONCCONCCCCCCCClCOCCCC/rB:s1;s2;s3;s4;s5;s6;d7;s7;s9;s10;d11;s11;s9s13;s13;s15;d16;s17;d18;d15s19;s18;s5;d22;s22;s24;s25;s24s26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H26ClN3O3
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:11.4215
Area:627.462
Solvation:-4.26502
Coulombic:-49.3723
Bond Count [?]
All:29
Single:23
Double:6
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:391.892
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:2.72
LogP (Chemaxon):2.48

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