Chemical ID: 5999825

CC(C)CN(CC(=O)N1CC(=O)N(C1)c2ccc(cc2)OC)C(=O)C(c3ccccc3)c4ccccc4
Chemical ID:
5999825
Name [?]:
N-isobutyl-N-[[3-(4-methoxyphenyl)-4-oxo-imidazolidin-1-yl]carbonylmethyl]-2,2-diphenyl-acetamide
SMILES [?]:
CC(C)CN(CC(=O)N1CC(=O)N(C1)c2ccc(cc2)OC)C(=O)C(c3ccccc3)c4ccccc4
InChi [?]:
InChI=1/C30H33N3O4/c1-22(2)18-31(30(36)29(23-10-6-4-7-11-23)24-12-8-5-9-13-24)19-27(34)32-20-28(35)33(21-32)25-14-16-26(37-3)17-15-25/h4-17,22,29H,18-21H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,3,22,29,35,28,30,34,36,27,31,33,37,16,20,17,19,4,6,10,14,2,26,32,15,18,7,11,25,23,5,9,13,8,12,24,21/E:(1,2)(4,5)(6,7,8,9)(10,11,12,13)(14,15)(16,17)(23,24)/rA:37nCCCCNCCONCCONCCCCCCCOCCOCCCCCCCCCCCCC/rB:s1;s2;s2;s4;s5;s6;d7;s7;s9;s10;d11;s11;s9s13;s13;s15;d16;s17;d18;d15s19;s18;s21;s5;d23;s23;s25;s26;d27;s28;d29;d26s30;s25;s32;d33;s34;d35;d32s36;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C30H33N3O4
All Atoms:37
Heavy Atoms:37
Chiral Atoms:0
ZAP Information [?]
Total:11.6208
Area:727.519
Solvation:-6.56721
Coulombic:-58.2183
Bond Count [?]
All:40
Single:28
Double:12
Rotors:11
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:499.601
H-Bond Donors:0
H-Bond Acceptors:7
XLogP:4.16
LogP (Chemaxon):4.26

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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