Chemical ID: 4460187

COC(=O)COc1ccc(cc1)S(=O)(=O)Nc2ccc(cc2)F
Chemical ID:
4460187
Name [?]:
methyl 2-[4-[(4-fluorophenyl)sulfamoyl]phenoxy]acetate
SMILES [?]:
COC(=O)COc1ccc(cc1)S(=O)(=O)Nc2ccc(cc2)F
InChi [?]:
InChI=1/C15H14FNO5S/c1-21-15(18)10-22-13-6-8-14(9-7-13)23(19,20)17-12-4-2-11(16)3-5-12/h2-9,17H,10H2,1H3
InChi Info:
AuxInfo=1/0/N:1,19,21,18,22,8,12,9,11,5,20,17,7,10,3,23,16,4,14,15,2,6,13/E:(2,3)(4,5)(6,7)(8,9)(19,20)/CRV:23.6/rA:23nCOCOCOCCCCCCSOONCCCCCCF/rB:s1;s2;d3;s3;s5;s6;s7;d8;s9;d10;d7s11;s10;d13;d13;s13;s16;s17;d18;s19;d20;d17s21;s20;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H14FNO5S
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:7.34944
Area:516.55
Solvation:-5.56432
Coulombic:-41.4345
Bond Count [?]
All:24
Single:15
Double:9
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:339.34
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:2.49
LogP (Chemaxon):2.07

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Descriptor Annotations

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