Chemical ID: 3970354

CC(C)CC1C(=O)N(C(=O)N1CC=C)C(C(C)C)C(=O)O
Chemical ID:
3970354
Name [?]:
2-(3-allyl-4-isobutyl-2,5-dioxo-imidazolidin-1-yl)-3-methyl-butanoic acid
SMILES [?]:
CC(C)CC1C(=O)N(C(=O)N1CC=C)C(C(C)C)C(=O)O
InChi [?]:
InChI=1/C15H24N2O4/c1-6-7-16-11(8-9(2)3)13(18)17(15(16)21)12(10(4)5)14(19)20/h6,9-12H,1,7-8H2,2-5H3,(H,19,20)
InChi Info:
AuxInfo=1/1/N:14,1,3,17,18,13,12,4,2,16,5,15,6,19,9,11,8,7,20,21,10/E:(2,3)(4,5)(19,20)/rA:21cCCCCCCONCONCCCCCCCCOO/rB:s1;s2;s2;s4;s5;d6;s6;s8;d9;s5s9;s11;s12;d13;s8;s15;s16;s16;s15;d19;s19;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H24N2O4
All Atoms:21
Heavy Atoms:21
Chiral Atoms:2
ZAP Information [?]
Total:8.71909
Area:466.48
Solvation:-2.94291
Coulombic:-64.6041
Bond Count [?]
All:21
Single:17
Double:4
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:296.362
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:2.11
LogP (Chemaxon):2.57

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