Chemical ID: 7297034

Cc1cc(ccc1OC(C)C(=O)NCc2ccccc2OC)Cl
Chemical ID:
7297034
Name [?]:
2-(4-chloro-2-methyl-phenoxy)-N-[(2-methoxyphenyl)methyl]propanamide
SMILES [?]:
Cc1cc(ccc1OC(C)C(=O)NCc2ccccc2OC)Cl
InChi [?]:
InChI=1/C18H20ClNO3/c1-12-10-15(19)8-9-16(12)23-13(2)18(21)20-11-14-6-4-5-7-17(14)22-3/h4-10,13H,11H2,1-3H3,(H,20,21)
InChi Info:
AuxInfo=1/1/N:1,10,22,17,18,16,19,5,6,3,14,2,9,15,4,7,20,11,23,13,12,21,8/rA:23cCCCCCCCOCCCONCCCCCCCOCCl/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;s9;s9;d11;s11;s13;s14;s15;d16;s17;d18;d15s19;s20;s21;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H20ClNO3
All Atoms:43
Heavy Atoms:23
Chiral Atoms:1
ZAP Information [?]
Total:9.10058
Area:558.063
Solvation:-4.851
Coulombic:-37.7991
Bond Count [?]
All:24
Single:17
Double:7
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:333.809
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:4.11
LogP (Chemaxon):3.76

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