Chemical ID: 6664545

CCCCN(c1ccccc1)C(=O)Nc2ccc(cc2C)C
Chemical ID:
6664545
Name [?]:
1-butyl-3-(2,4-dimethylphenyl)-1-phenyl-urea
SMILES [?]:
CCCCN(c1ccccc1)C(=O)Nc2ccc(cc2C)C
InChi [?]:
InChI=1/C19H24N2O/c1-4-5-13-21(17-9-7-6-8-10-17)19(22)20-18-12-11-15(2)14-16(18)3/h6-12,14H,4-5,13H2,1-3H3,(H,20,22)
InChi Info:
AuxInfo=1/1/N:1,22,21,2,3,9,8,10,7,11,17,16,4,19,18,20,6,15,12,14,5,13/E:(7,8)(9,10)/rA:22nCCCCNCCCCCCCONCCCCCCCC/rB:s1;s2;s3;s4;s5;s6;d7;s8;d9;d6s10;s5;d12;s12;s14;s15;d16;s17;d18;d15s19;s20;s18;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H24N2O
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:11.4812
Area:521.945
Solvation:-1.56744
Coulombic:-32.9579
Bond Count [?]
All:23
Single:16
Double:7
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:296.407
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.64
LogP (Chemaxon):4.77

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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