Chemical ID: 4339796

c1ccc(cc1)NC(=O)N(CCC#N)Cc2cccnc2
Chemical ID:
4339796
Name [?]:
1-(2-cyanoethyl)-3-phenyl-1-(3-pyridylmethyl)urea
SMILES [?]:
c1ccc(cc1)NC(=O)N(CCC#N)Cc2cccnc2
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H16N4O
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:9.08671
Area:502.445
Solvation:-3.47442
Coulombic:-37.2527
Bond Count [?]
All:22
Single:14
Double:7
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:280.325
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:1.17
LogP (Chemaxon):2.12

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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