Chemical ID: 5155874

c1cc(ccc1N)S(=O)(=O)CC(=O)N2CCOCC2
Chemical ID:
5155874
Name [?]:
2-(4-aminophenyl)sulfonyl-1-morpholino-ethanone
SMILES [?]:
c1cc(ccc1N)S(=O)(=O)CC(=O)N2CCOCC2
InChi [?]:
InChI=1/C12H16N2O4S/c13-10-1-3-11(4-2-10)19(16,17)9-12(15)14-5-7-18-8-6-14/h1-4H,5-9,13H2
InChi Info:
AuxInfo=1/0/N:1,5,2,4,15,19,16,18,11,6,3,12,7,14,13,9,10,17,8/E:(1,2)(3,4)(5,6)(7,8)(16,17)/CRV:19.6/rA:19nCCCCCCNSOOCCONCCOCC/rB:s1;d2;s3;d4;d1s5;s6;s3;d8;d8;s8;s11;d12;s12;s14;s15;s16;s17;s14s18;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H16N2O4S
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:5.28897
Area:459.227
Solvation:-6.19171
Coulombic:-40.836
Bond Count [?]
All:20
Single:14
Double:6
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:284.333
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:-1.13
LogP (Chemaxon):-0.76

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