Chemical ID: 5509436

CN(C(c1ccccc1)c2ccccc2)C(=O)Cc3c(cccc3Cl)Cl
Chemical ID:
5509436
Name [?]:
N-benzhydryl-2-(2,6-dichlorophenyl)-N-methyl-acetamide
SMILES [?]:
CN(C(c1ccccc1)c2ccccc2)C(=O)Cc3c(cccc3Cl)Cl
InChi [?]:
InChI=1/C22H19Cl2NO/c1-25(21(26)15-18-19(23)13-8-14-20(18)24)22(16-9-4-2-5-10-16)17-11-6-3-7-12-17/h2-14,22H,15H2,1H3
InChi Info:
AuxInfo=1/0/N:1,7,13,6,8,12,14,22,5,9,11,15,21,23,18,4,10,19,20,24,16,3,26,25,2,17/E:(2,3)(4,5,6,7)(9,10,11,12)(13,14)(16,17)(19,20)(23,24)/rA:26nCNCCCCCCCCCCCCCCOCCCCCCCClCl/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s3;s10;d11;s12;d13;d10s14;s2;d16;s16;s18;s19;d20;s21;d22;d19s23;s24;s20;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H19Cl2NO
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:11.4364
Area:564.416
Solvation:-2.674
Coulombic:-20.9607
Bond Count [?]
All:28
Single:18
Double:10
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:384.298
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:5.91
LogP (Chemaxon):5.97

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Descriptor Annotations

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