Chemical ID: 5761693

CN(C)c1cccc(c1)C(=O)Nc2cccc(c2)Br
Chemical ID:
5761693
Name [?]:
N-(3-bromophenyl)-3-dimethylamino-benzamide
SMILES [?]:
CN(C)c1cccc(c1)C(=O)Nc2cccc(c2)Br
InChi [?]:
InChI=1/C15H15BrN2O/c1-18(2)14-8-3-5-11(9-14)15(19)17-13-7-4-6-12(16)10-13/h3-10H,1-2H3,(H,17,19)
InChi Info:
AuxInfo=1/1/N:1,3,6,15,7,16,14,5,9,18,8,17,13,4,10,19,12,2,11/E:(1,2)/rA:19nCNCCCCCCCCONCCCCCCBr/rB:s1;s2;s2;s4;d5;s6;d7;d4s8;s8;d10;s10;s12;s13;d14;s15;d16;d13s17;s17;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H15BrN2O
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:9.64489
Area:470.854
Solvation:-2.12646
Coulombic:-28.9678
Bond Count [?]
All:20
Single:13
Double:7
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:319.196
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.0
LogP (Chemaxon):4.16

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