Chemical ID: 7309774

CCCCCCC1(C(=O)N(C(=O)N1)CC(=O)Nc2cccc(c2)Cl)C
Chemical ID:
7309774
Name [?]:
N-(3-chlorophenyl)-2-(4-hexyl-4-methyl-2,5-dioxo-imidazolidin-1-yl)-acetamide
SMILES [?]:
CCCCCCC1(C(=O)N(C(=O)N1)CC(=O)Nc2cccc(c2)Cl)C
InChi [?]:
InChI=1/C18H24ClN3O3/c1-3-4-5-6-10-18(2)16(24)22(17(25)21-18)12-15(23)20-14-9-7-8-13(19)11-14/h7-9,11H,3-6,10,12H2,1-2H3,(H,20,23)(H,21,25)
InChi Info:
AuxInfo=1/1/N:1,25,2,3,4,5,20,21,19,6,23,14,22,18,15,8,11,7,24,17,13,10,16,9,12/rA:25cCCCCCCCCONCONCCONCCCCCCClC/rB:s1;s2;s3;s4;s5;s6;s7;d8;s8;s10;d11;s7s11;s10;s14;d15;s15;s17;s18;d19;s20;d21;d18s22;s22;s7;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H24ClN3O3
All Atoms:49
Heavy Atoms:25
Chiral Atoms:1
ZAP Information [?]
Total:11.6473
Area:605.558
Solvation:-3.49169
Coulombic:-61.514
Bond Count [?]
All:26
Single:20
Double:6
Rotors:9
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:365.854
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:3.45
LogP (Chemaxon):3.29

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Descriptor Annotations

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