Chemical ID: 4183359

Cc1ccc(c(c1)Br)NC(=O)c2ccccc2OC
Chemical ID:
4183359
Name [?]:
N-(2-bromo-4-methyl-phenyl)-2-methoxy-benzamide
SMILES [?]:
Cc1ccc(c(c1)Br)NC(=O)c2ccccc2OC
InChi [?]:
InChI=1/C15H14BrNO2/c1-10-7-8-13(12(16)9-10)17-15(18)11-5-3-4-6-14(11)19-2/h3-9H,1-2H3,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,19,14,15,13,16,3,4,7,2,12,6,5,17,10,8,9,11,18/rA:19nCCCCCCCBrNCOCCCCCCOC/rB:s1;s2;d3;s4;d5;d2s6;s6;s5;s9;d10;s10;s12;d13;s14;d15;d12s16;s17;s18;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H14BrNO2
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:7.9306
Area:455.552
Solvation:-3.45819
Coulombic:-29.4009
Bond Count [?]
All:20
Single:13
Double:7
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:320.181
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.14
LogP (Chemaxon):3.46

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