Chemical ID: 7504906

c1ccc(cc1)COc2ccc(cc2)C(=O)Nc3cccc(c3)Cl
Chemical ID:
7504906
Name [?]:
4-benzyloxy-N-(3-chlorophenyl)-benzamide
SMILES [?]:
c1ccc(cc1)COc2ccc(cc2)C(=O)Nc3cccc(c3)Cl
InChi [?]:
InChI=1/C20H16ClNO2/c21-17-7-4-8-18(13-17)22-20(23)16-9-11-19(12-10-16)24-14-15-5-2-1-3-6-15/h1-13H,14H2,(H,22,23)
InChi Info:
AuxInfo=1/1/N:1,2,6,20,3,5,21,19,11,13,10,14,23,7,4,12,22,18,9,15,24,17,16,8/E:(2,3)(5,6)(9,10)(11,12)/rA:24nCCCCCCCOCCCCCCCONCCCCCCCl/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;s9;d10;s11;d12;d9s13;s12;d15;s15;s17;s18;d19;s20;d21;d18s22;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H16ClNO2
All Atoms:40
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:10.7399
Area:563.824
Solvation:-3.35566
Coulombic:-32.1824
Bond Count [?]
All:26
Single:16
Double:10
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:337.799
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:5.24
LogP (Chemaxon):5.14

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Descriptor Annotations

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