Chemical ID: 7359696

CN(Cc1cccc(c1Cl)Cl)C(=O)c2ccc(cc2)I
Chemical ID:
7359696
Name [?]:
N-[(2,3-dichlorophenyl)methyl]-4-iodo-N-methyl-benzamide
SMILES [?]:
CN(Cc1cccc(c1Cl)Cl)C(=O)c2ccc(cc2)I
InChi [?]:
InChI=1/C15H12Cl2INO/c1-19(9-11-3-2-4-13(16)14(11)17)15(20)10-5-7-12(18)8-6-10/h2-8H,9H2,1H3
InChi Info:
AuxInfo=1/0/N:1,6,5,7,15,19,16,18,3,14,4,17,8,9,12,11,10,20,2,13/E:(5,6)(7,8)/rA:20nCNCCCCCCCClClCOCCCCCCI/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;s8;s2;d12;s12;s14;d15;s16;d17;d14s18;s17;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H12Cl2INO
All Atoms:32
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:10.3188
Area:497.126
Solvation:-2.10938
Coulombic:-20.2656
Bond Count [?]
All:21
Single:14
Double:7
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:420.072
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:5.59
LogP (Chemaxon):4.99

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Descriptor Annotations

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