Chemical ID: 4291620

Cc1ccc(c(c1)NS(=O)(=O)c2c(cc(cc2C(C)C)C(C)C)C(C)C)C
Chemical ID:
4291620
Name [?]:
N-(2,5-dimethylphenyl)-2,4,6-triisopropyl-benzenesulfonamide
SMILES [?]:
Cc1ccc(c(c1)NS(=O)(=O)c2c(cc(cc2C(C)C)C(C)C)C(C)C)C
InChi [?]:
InChI=1/C23H33NO2S/c1-14(2)19-12-20(15(3)4)23(21(13-19)16(5)6)27(25,26)24-22-11-17(7)9-10-18(22)8/h9-16,24H,1-8H3
InChi Info:
AuxInfo=1/0/N:22,23,19,20,25,26,1,27,3,4,7,16,14,21,18,24,2,5,15,17,13,6,12,8,10,11,9/E:(1,2)(3,4,5,6)(12,13)(15,16)(20,21)(25,26)/CRV:27.6/rA:27nCCCCCCCNSOOCCCCCCCCCCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;d9;s9;s12;d13;s14;d15;d12s16;s17;s18;s18;s15;s21;s21;s13;s24;s24;s5;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C23H33NO2S
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:12.444
Area:558.396
Solvation:-1.51594
Coulombic:-16.1617
Bond Count [?]
All:28
Single:20
Double:8
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:387.58
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:7.17
LogP (Chemaxon):7.12

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Descriptor Annotations

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