Chemical ID: 7361048

CC(c1ccc(cc1Cl)Cl)NC(=O)c2ccccc2Br
Chemical ID:
7361048
Name [?]:
2-bromo-N-[1-(2,4-dichlorophenyl)ethyl]benzamide
SMILES [?]:
CC(c1ccc(cc1Cl)Cl)NC(=O)c2ccccc2Br
InChi [?]:
InChI=1/C15H12BrCl2NO/c1-9(11-7-6-10(17)8-14(11)18)19-15(20)12-4-2-3-5-13(12)16/h2-9H,1H3,(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,16,17,15,18,5,4,7,2,6,3,14,19,8,12,20,10,9,11,13/rA:20cCCCCCCCCClClNCOCCCCCCBr/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s6;s2;s11;d12;s12;s14;d15;s16;d17;d14s18;s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H12BrCl2NO
All Atoms:32
Heavy Atoms:20
Chiral Atoms:1
ZAP Information [?]
Total:10.646
Area:504.414
Solvation:-1.96434
Coulombic:-24.7463
Bond Count [?]
All:21
Single:14
Double:7
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:373.071
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:5.7
LogP (Chemaxon):4.96

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