Chemical ID: 5999643

Cc1ccc(cc1)C(=O)N(CC(C)C)CC(=O)N2CC(=O)N(C2)c3ccc(cc3)Cl
Chemical ID:
5999643
Name [?]:
N-[[3-(4-chlorophenyl)-4-oxo-imidazolidin-1-yl]carbonylmethyl]-N-isobutyl-4-methyl-benzamide
SMILES [?]:
Cc1ccc(cc1)C(=O)N(CC(C)C)CC(=O)N2CC(=O)N(C2)c3ccc(cc3)Cl
InChi [?]:
InChI=1/C23H26ClN3O3/c1-16(2)12-25(23(30)18-6-4-17(3)5-7-18)13-21(28)26-14-22(29)27(15-26)20-10-8-19(24)9-11-20/h4-11,16H,12-15H2,1-3H3
InChi Info:
AuxInfo=1/0/N:13,14,1,3,7,4,6,26,28,25,29,11,15,19,23,12,2,5,27,24,16,20,8,30,10,18,22,17,21,9/E:(1,2)(4,5)(6,7)(8,9)(10,11)/rA:30nCCCCCCCCONCCCCCCONCCONCCCCCCCCl/rB:s1;s2;d3;s4;d5;d2s6;s5;d8;s8;s10;s11;s12;s12;s10;s15;d16;s16;s18;s19;d20;s20;s18s22;s22;s24;d25;s26;d27;d24s28;s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C23H26ClN3O3
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:12.1319
Area:661.198
Solvation:-4.39806
Coulombic:-51.4521
Bond Count [?]
All:32
Single:23
Double:9
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:427.924
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:3.83
LogP (Chemaxon):3.6

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Descriptor Annotations

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