Chemical ID: 6188334

c1cc(c(cc1NS(=O)(=O)c2ccc3c(c2)[nH]c(=O)c(=O)[nH]3)F)F
Chemical ID:
6188334
Name [?]:
N-(3,4-difluorophenyl)-2,3-dioxo-1,4-dihydroquinoxaline-6-sulfonamide
SMILES [?]:
c1cc(c(cc1NS(=O)(=O)c2ccc3c(c2)[nH]c(=O)c(=O)[nH]3)F)F
InChi [?]:
InChI=1/C14H9F2N3O4S/c15-9-3-1-7(5-10(9)16)19-24(22,23)8-2-4-11-12(6-8)18-14(21)13(20)17-11/h1-6,19H,(H,17,20)(H,18,21)
InChi Info:
AuxInfo=1/1/N:1,12,2,13,5,16,6,11,3,4,14,15,20,18,24,23,22,17,7,21,19,9,10,8/E:(22,23)/CRV:24.6/rA:24nCCCCCCNSOOCCCCCCNCOCONFF/rB:s1;d2;s3;d4;d1s5;s6;s7;d8;d8;s8;s11;d12;s13;d14;d11s15;s15;s17;d18;s18;d20;s14s20;s4;s3;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H9F2N3O4S
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:6.54107
Area:486.41
Solvation:-5.61918
Coulombic:-61.9023
Bond Count [?]
All:26
Single:16
Double:10
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:353.302
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:1.02
LogP (Chemaxon):1.66

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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