Chemical ID: 7432288

CC(C)N(C1CCCCC1)C(=O)Nc2ccccc2F
Chemical ID:
7432288
Name [?]:
1-cyclohexyl-3-(2-fluorophenyl)-1-isopropyl-urea
SMILES [?]:
CC(C)N(C1CCCCC1)C(=O)Nc2ccccc2F
InChi [?]:
InChI=1/C16H23FN2O/c1-12(2)19(13-8-4-3-5-9-13)16(20)18-15-11-7-6-10-14(15)17/h6-7,10-13H,3-5,8-9H2,1-2H3,(H,18,20)
InChi Info:
AuxInfo=1/1/N:1,3,8,7,9,17,16,6,10,18,15,2,5,19,14,11,20,13,4,12/E:(1,2)(4,5)(8,9)/rA:20nCCCNCCCCCCCONCCCCCCF/rB:s1;s2;s2;s4;s5;s6;s7;s8;s5s9;s4;d11;s11;s13;s14;d15;s16;d17;d14s18;s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H23FN2O
All Atoms:43
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:9.74802
Area:460.236
Solvation:-1.75788
Coulombic:-36.5976
Bond Count [?]
All:21
Single:17
Double:4
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:278.365
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:3.93
LogP (Chemaxon):3.42

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