Chemical ID: 7063113

c1ccc(c(c1)S(=O)(=O)N2CCc3cccc4c3C2CC4)Cl
Chemical ID:
7063113
Name [?]:
None
SMILES [?]:
c1ccc(c(c1)S(=O)(=O)N2CCc3cccc4c3C2CC4)Cl
InChi [?]:
InChI=1/C17H16ClNO2S/c18-14-6-1-2-7-16(14)22(20,21)19-11-10-13-5-3-4-12-8-9-15(19)17(12)13/h1-7,15H,8-11H2
InChi Info:
AuxInfo=1/0/N:2,1,15,16,14,3,6,21,20,12,11,17,13,4,19,5,18,22,10,8,9,7/E:(20,21)/CRV:22.6/rA:22cCCCCCCSOONCCCCCCCCCCCCl/rB:s1;d2;s3;d4;d1s5;s5;d7;d7;s7;s10;s11;s12;s13;d14;s15;d16;d13s17;s10s18;s19;s17s20;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H16ClNO2S
All Atoms:38
Heavy Atoms:22
Chiral Atoms:2
ZAP Information [?]
Total:9.30863
Area:458.972
Solvation:-2.16566
Coulombic:-9.66728
Bond Count [?]
All:25
Single:17
Double:8
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:333.833
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:3.6
LogP (Chemaxon):3.9

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