Chemical ID: 7063110

Cc1cccc(c1)S(=O)(=O)N2CCc3cccc4c3C2CC4
Chemical ID:
7063110
Name [?]:
None
SMILES [?]:
Cc1cccc(c1)S(=O)(=O)N2CCc3cccc4c3C2CC4
InChi [?]:
InChI=1/C18H19NO2S/c1-13-4-2-7-16(12-13)22(20,21)19-11-10-15-6-3-5-14-8-9-17(19)18(14)15/h2-7,12,17H,8-11H2,1H3
InChi Info:
AuxInfo=1/0/N:1,4,16,3,17,15,5,22,21,13,12,7,2,18,14,6,20,19,11,9,10,8/E:(20,21)/CRV:22.6/rA:22cCCCCCCCSOONCCCCCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s6;d8;d8;s8;s11;s12;s13;s14;d15;s16;d17;d14s18;s11s19;s20;s18s21;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H19NO2S
All Atoms:41
Heavy Atoms:22
Chiral Atoms:2
ZAP Information [?]
Total:9.51697
Area:457.453
Solvation:-1.91935
Coulombic:-9.67501
Bond Count [?]
All:25
Single:17
Double:8
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:313.415
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:3.41
LogP (Chemaxon):3.85

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