Chemical ID: 6472497

c1cc(c(cc1Br)S(=O)(=O)N2CCCC2)Br
Chemical ID:
6472497
Name [?]:
1-(2,5-dibromophenyl)sulfonylpyrrolidine
SMILES [?]:
c1cc(c(cc1Br)S(=O)(=O)N2CCCC2)Br
InChi [?]:
InChI=1/C10H11Br2NO2S/c11-8-3-4-9(12)10(7-8)16(14,15)13-5-1-2-6-13/h3-4,7H,1-2,5-6H2
InChi Info:
AuxInfo=1/0/N:13,14,1,2,12,15,5,6,3,4,7,16,11,9,10,8/E:(1,2)(5,6)(14,15)/CRV:16.6/rA:16nCCCCCCBrSOONCCCCBr/rB:s1;d2;s3;d4;d1s5;s6;s4;d8;d8;s8;s11;s12;s13;s11s14;s3;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H11Br2NO2S
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:8.40721
Area:408.064
Solvation:-1.79438
Coulombic:-7.48158
Bond Count [?]
All:17
Single:12
Double:5
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:369.074
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:3.21
LogP (Chemaxon):3.08

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