Chemical ID: 4754113

CC(C)N(CCC#N)C(=O)Nc1ccc(cc1)C(C)(C)C
Chemical ID:
4754113
Name [?]:
1-(2-cyanoethyl)-1-isopropyl-3-(4-tert-butylphenyl)-urea
SMILES [?]:
CC(C)N(CCC#N)C(=O)Nc1ccc(cc1)C(C)(C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H25N3O
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:10.7524
Area:523.805
Solvation:-2.34272
Coulombic:-33.7626
Bond Count [?]
All:21
Single:16
Double:4
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:287.4
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.41
LogP (Chemaxon):4.04

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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