Chemical ID: 5999655

Cc1ccccc1C(=O)N(CC(=O)N2CC(=O)N(C2)c3ccc(cc3)Cl)C(C)C
Chemical ID:
5999655
Name [?]:
N-[[3-(4-chlorophenyl)-4-oxo-imidazolidin-1-yl]carbonylmethyl]-N-isopropyl-2-methyl-benzamide
SMILES [?]:
Cc1ccccc1C(=O)N(CC(=O)N2CC(=O)N(C2)c3ccc(cc3)Cl)C(C)C
InChi [?]:
InChI=1/C22H24ClN3O3/c1-15(2)25(22(29)19-7-5-4-6-16(19)3)13-20(27)24-12-21(28)26(14-24)18-10-8-17(23)9-11-18/h4-11,15H,12-14H2,1-3H3
InChi Info:
AuxInfo=1/0/N:28,29,1,4,5,3,6,22,24,21,25,15,11,19,27,2,23,20,7,12,16,8,26,14,10,18,13,17,9/E:(1,2)(8,9)(10,11)/rA:29nCCCCCCCCONCCONCCONCCCCCCCClCCC/rB:s1;s2;d3;s4;d5;d2s6;s7;d8;s8;s10;s11;d12;s12;s14;s15;d16;s16;s14s18;s18;s20;d21;s22;d23;d20s24;s23;s10;s27;s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H24ClN3O3
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:11.6065
Area:629.656
Solvation:-4.13493
Coulombic:-51.4211
Bond Count [?]
All:31
Single:22
Double:9
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:413.897
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:3.63
LogP (Chemaxon):3.14

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Descriptor Annotations

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