Chemical ID: 7528122

c1ccc(cc1)C(C(=O)O)NC(=O)NC23CC4CC(C2)CC(C4)C3
Chemical ID:
7528122
Name [?]:
2-(1-adamantylcarbamoylamino)-2-phenyl-acetic acid
SMILES [?]:
c1ccc(cc1)C(C(=O)O)NC(=O)NC23CC4CC(C2)CC(C4)C3
InChi [?]:
InChI=1/C19H24N2O3/c22-17(23)16(15-4-2-1-3-5-15)20-18(24)21-19-9-12-6-13(10-19)8-14(7-12)11-19/h1-5,12-14,16H,6-11H2,(H,22,23)(H2,20,21,24)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,5,18,21,23,20,16,24,19,17,22,4,7,8,12,15,11,14,9,10,13/E:(2,3)(4,5)(6,7,8)(9,10,11)(12,13,14)(22,23)/rA:24cCCCCCCCCOONCONCCCCCCCCCC/rB:s1;d2;s3;d4;d1s5;s4;s7;d8;s8;s7;s11;d12;s12;s14;s15;s16;s17;s18;s15s19;s19;s21;s17s22;s15s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H24N2O3
All Atoms:48
Heavy Atoms:24
Chiral Atoms:None
ZAP Information [?]
Total:10.0372
Area:507.821
Solvation:-2.65838
Coulombic:-64.1946
Bond Count [?]
All:27
Single:22
Double:5
Rotors:6
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:3.19
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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