Chemical ID: 7257513

CCCOc1ccccc1NC(=O)Cc2ccc(cc2)Cl
Chemical ID:
7257513
Name [?]:
2-(4-chlorophenyl)-N-(2-propoxyphenyl)-acetamide
SMILES [?]:
CCCOc1ccccc1NC(=O)Cc2ccc(cc2)Cl
InChi [?]:
InChI=1/C17H18ClNO2/c1-2-11-21-16-6-4-3-5-15(16)19-17(20)12-13-7-9-14(18)10-8-13/h3-10H,2,11-12H2,1H3,(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,2,8,7,9,6,16,20,17,19,3,14,15,18,10,5,12,21,11,13,4/E:(7,8)(9,10)/rA:21nCCCOCCCCCCNCOCCCCCCCCl/rB:s1;s2;s3;s4;s5;d6;s7;d8;d5s9;s10;s11;d12;s12;s14;s15;d16;s17;d18;d15s19;s18;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H18ClNO2
All Atoms:39
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:10.0632
Area:526.713
Solvation:-3.10463
Coulombic:-30.4147
Bond Count [?]
All:22
Single:15
Double:7
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:303.783
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.12
LogP (Chemaxon):4.29

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue