Chemical ID: 4016423

CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCN(CC2)C(=O)C
Chemical ID:
4016423
Name [?]:
N-[4-(4-acetylpiperazin-1-yl)sulfonylphenyl]acetamide
SMILES [?]:
CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCN(CC2)C(=O)C
InChi [?]:
InChI=1/C14H19N3O4S/c1-11(18)15-13-3-5-14(6-4-13)22(20,21)17-9-7-16(8-10-17)12(2)19/h3-6H,7-10H2,1-2H3,(H,15,18)
InChi Info:
AuxInfo=1/1/N:1,22,6,10,7,9,16,18,15,19,2,20,5,8,4,17,14,3,21,12,13,11/E:(3,4)(5,6)(7,8)(9,10)(20,21)/CRV:22.6/rA:22nCCONCCCCCCSOONCCNCCCOC/rB:s1;d2;s2;s4;s5;d6;s7;d8;d5s9;s8;d11;d11;s11;s14;s15;s16;s17;s14s18;s17;d20;s20;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H19N3O4S
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:8.35943
Area:510.669
Solvation:-4.40728
Coulombic:-40.1922
Bond Count [?]
All:23
Single:16
Double:7
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:325.384
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:-0.2
LogP (Chemaxon):-0.4

Name Annotations

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Descriptor Annotations

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