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Chemical ID: 6925164
Chemical ID:
6925164
Name [?]:
N-[4-(hexylsulfamoyl)phenyl]pentanamide
SMILES [?]:
CCCCCCNS(=O)(=O)c1ccc(cc1)NC(=O)CCCC
InChi [?]:
InChI=1/C17H28N2O3S/c1-3-5-7-8-14-18-23(21,22)16-12-10-15(11-13-16)19-17(20)9-6-4-2/h10-13,18H,3-9,14H2,1-2H3,(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,23,2,22,3,21,4,5,20,13,15,12,16,6,14,11,18,7,17,19,9,10,8/E:(10,11)(12,13)(21,22)/CRV:23.6/rA:23nCCCCCCNSOOCCCCCCNCOCCCC/rB:s1;s2;s3;s4;s5;s6;s7;d8;d8;s8;s11;d12;s13;d14;d11s15;s14;s17;d18;s18;s20;s21;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C17H28N2O3S |
All Atoms: | 51 |
Heavy Atoms: | 23 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 12.2768 |
Area: | 604.913 |
Solvation: | -2.84605 |
Coulombic: | -33.4267 |
Bond Count [?]
All: | 23 |
Single: | 17 |
Double: | 6 |
Rotors: | 12 |
Chiral: | 0 |
Rigid Segments: | 8 |
Chemical Properties
Molecular Weight: | 340.482 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 5 |
XLogP: | 4.0 |
LogP (Chemaxon): | 3.67 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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