Chemical ID: 4181718

Cc1ccc(cc1S(=O)(=O)N2CCOCC2)C(=O)N
Chemical ID:
4181718
Name [?]:
4-methyl-3-morpholinosulfonyl-benzamide
SMILES [?]:
Cc1ccc(cc1S(=O)(=O)N2CCOCC2)C(=O)N
InChi [?]:
InChI=1/C12H16N2O4S/c1-9-2-3-10(12(13)15)8-11(9)19(16,17)14-4-6-18-7-5-14/h2-3,8H,4-7H2,1H3,(H2,13,15)
InChi Info:
AuxInfo=1/1/N:1,3,4,12,16,13,15,6,2,5,7,17,19,11,18,9,10,14,8/E:(4,5)(6,7)(16,17)/CRV:19.6/rA:19nCCCCCCCSOONCCOCCCON/rB:s1;s2;d3;s4;d5;d2s6;s7;d8;d8;s8;s11;s12;s13;s14;s11s15;s5;d17;s17;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H16N2O4S
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:6.84819
Area:436.397
Solvation:-4.06173
Coulombic:-40.7394
Bond Count [?]
All:20
Single:14
Double:6
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:284.333
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:-0.18
LogP (Chemaxon):-0.05

Name Annotations

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Descriptor Annotations

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