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Chemical ID: 7252819
Chemical ID:
7252819
Name [?]:
2-(3-benzyl-2,4,5-trioxo-imidazolidin-1-yl)-N-phenyl-acetamide
SMILES [?]:
c1ccc(cc1)CN2C(=O)C(=O)N(C2=O)CC(=O)Nc3ccccc3
InChi [?]:
InChI=1/C18H15N3O4/c22-15(19-14-9-5-2-6-10-14)12-21-17(24)16(23)20(18(21)25)11-13-7-3-1-4-8-13/h1-10H,11-12H2,(H,19,22)
InChi Info:
AuxInfo=1/1/N:1,23,2,6,22,24,3,5,21,25,7,16,4,20,17,9,11,14,19,8,13,18,10,12,15/E:(3,4)(5,6)(7,8)(9,10)/rA:25nCCCCCCCNCOCONCOCCONCCCCCC/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;d9;s9;d11;s11;s8s13;d14;s13;s16;d17;s17;s19;s20;d21;s22;d23;d20s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C18H15N3O4 |
All Atoms: | 40 |
Heavy Atoms: | 25 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 9.37154 |
Area: | 539.266 |
Solvation: | -4.11012 |
Coulombic: | -68.2813 |
Bond Count [?]
All: | 27 |
Single: | 17 |
Double: | 10 |
Rotors: | 6 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 337.33 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 7 |
XLogP: | 1.29 |
LogP (Chemaxon): | 2.14 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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