Chemical ID: 4427074

CC(c1ccccc1)C(=O)Nc2ccc(c(c2)Cl)OC
Chemical ID:
4427074
Name [?]:
N-(3-chloro-4-methoxy-phenyl)-2-phenyl-propanamide
SMILES [?]:
CC(c1ccccc1)C(=O)Nc2ccc(c(c2)Cl)OC
InChi [?]:
InChI=1/C16H16ClNO2/c1-11(12-6-4-3-5-7-12)16(19)18-13-8-9-15(20-2)14(17)10-13/h3-11H,1-2H3,(H,18,19)
InChi Info:
AuxInfo=1/1/N:1,20,6,5,7,4,8,13,14,17,2,3,12,16,15,9,18,11,10,19/E:(4,5)(6,7)/rA:20cCCCCCCCCCONCCCCCCClOC/rB:s1;s2;s3;d4;s5;d6;d3s7;s2;d9;s9;s11;s12;d13;s14;d15;d12s16;s16;s15;s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H16ClNO2
All Atoms:20
Heavy Atoms:20
Chiral Atoms:1
ZAP Information [?]
Total:8.45165
Area:484.889
Solvation:-3.67057
Coulombic:-29.2086
Bond Count [?]
All:21
Single:14
Double:7
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:289.756
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:3.56
LogP (Chemaxon):4.05

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