Chemical ID: 6349264

c1cc(c(cc1Cl)S(=O)(=O)NC23CC4CC(C2)CC(C4)C3)Cl
Chemical ID:
6349264
Name [?]:
N-(1-adamantyl)-2,5-dichloro-benzenesulfonamide
SMILES [?]:
c1cc(c(cc1Cl)S(=O)(=O)NC23CC4CC(C2)CC(C4)C3)Cl
InChi [?]:
InChI=1/C16H19Cl2NO2S/c17-13-1-2-14(18)15(6-13)22(20,21)19-16-7-10-3-11(8-16)5-12(4-10)9-16/h1-2,6,10-12,19H,3-5,7-9H2
InChi Info:
AuxInfo=1/0/N:1,2,15,18,20,5,17,13,21,16,14,19,6,3,4,12,7,22,11,9,10,8/E:(3,4,5)(7,8,9)(10,11,12)(20,21)/CRV:22.6/rA:22nCCCCCCClSOONCCCCCCCCCCCl/rB:s1;d2;s3;d4;d1s5;s6;s4;d8;d8;s8;s11;s12;s13;s14;s15;s12s16;s16;s18;s14s19;s12s19;s3;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H19Cl2NO2S
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:9.95898
Area:468.516
Solvation:-1.75393
Coulombic:-13.8774
Bond Count [?]
All:25
Single:20
Double:5
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:360.299
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.99
LogP (Chemaxon):3.68

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Descriptor Annotations

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