Chemical ID: 4711455

c1ccc(cc1)C(CO)NC(=O)NC2CCCCC2
Chemical ID:
4711455
Name [?]:
3-cyclohexyl-1-(2-hydroxy-1-phenyl-ethyl)-urea
SMILES [?]:
c1ccc(cc1)C(CO)NC(=O)NC2CCCCC2
InChi [?]:
InChI=1/C15H22N2O2/c18-11-14(12-7-3-1-4-8-12)17-15(19)16-13-9-5-2-6-10-13/h1,3-4,7-8,13-14,18H,2,5-6,9-11H2,(H2,16,17,19)
InChi Info:
AuxInfo=1/1/N:1,17,2,6,16,18,3,5,15,19,8,4,14,7,11,13,10,9,12/E:(3,4)(5,6)(7,8)(9,10)/rA:19cCCCCCCCCONCONCCCCCC/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;s7;s10;d11;s11;s13;s14;s15;s16;s17;s14s18;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H22N2O2
All Atoms:19
Heavy Atoms:19
Chiral Atoms:1
ZAP Information [?]
Total:9.09875
Area:468.029
Solvation:-2.60198
Coulombic:-53.8866
Bond Count [?]
All:20
Single:16
Double:4
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:262.347
H-Bond Donors:3
H-Bond Acceptors:4
XLogP:2.28
LogP (Chemaxon):2.18

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Descriptor Annotations

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