Chemical ID: 5999676

CCc1ccc(cc1)C(=O)N(CC(=O)N2CC(=O)N(C2)c3ccc(cc3)Cl)C4CC4
Chemical ID:
5999676
Name [?]:
N-[[3-(4-chlorophenyl)-4-oxo-imidazolidin-1-yl]carbonylmethyl]-N-cyclopropyl-4-ethyl-benzamide
SMILES [?]:
CCc1ccc(cc1)C(=O)N(CC(=O)N2CC(=O)N(C2)c3ccc(cc3)Cl)C4CC4
InChi [?]:
InChI=1/C23H24ClN3O3/c1-2-16-3-5-17(6-4-16)23(30)26(19-11-12-19)14-21(28)25-13-22(29)27(15-25)20-9-7-18(24)8-10-20/h3-10,19H,2,11-15H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,4,8,5,7,23,25,22,26,29,30,16,12,20,3,6,24,28,21,13,17,9,27,15,11,19,14,18,10/E:(3,4)(5,6)(7,8)(9,10)(11,12)/rA:30nCCCCCCCCCONCCONCCONCCCCCCCClCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;d9;s9;s11;s12;d13;s13;s15;s16;d17;s17;s15s19;s19;s21;d22;s23;d24;d21s25;s24;s11;s28;s28s29;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C23H24ClN3O3
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:11.9751
Area:650.423
Solvation:-4.28551
Coulombic:-50.7965
Bond Count [?]
All:33
Single:24
Double:9
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:425.908
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:3.76
LogP (Chemaxon):3.18

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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