Chemical ID: 4082826

CN(Cc1ccccc1)C(=O)c2ccccc2Br
Chemical ID:
4082826
Name [?]:
N-benzyl-2-bromo-N-methyl-benzamide
SMILES [?]:
CN(Cc1ccccc1)C(=O)c2ccccc2Br
InChi [?]:
InChI=1/C15H14BrNO/c1-17(11-12-7-3-2-4-8-12)15(18)13-9-5-6-10-14(13)16/h2-10H,11H2,1H3
InChi Info:
AuxInfo=1/0/N:1,7,6,8,14,15,5,9,13,16,3,4,12,17,10,18,2,11/E:(3,4)(7,8)/rA:18nCNCCCCCCCCOCCCCCCBr/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s2;d10;s10;s12;d13;s14;d15;d12s16;s17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H14BrNO
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:9.01482
Area:436.217
Solvation:-1.89061
Coulombic:-20.2881
Bond Count [?]
All:19
Single:12
Double:7
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:304.182
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:4.08
LogP (Chemaxon):3.76

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Descriptor Annotations

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