Chemical ID: 5788882

CS(=O)(=O)Nc1ccc(cc1Oc2ccccc2)N(=O)=O
Chemical ID:
5788882
Name [?]:
N-(4-nitro-2-phenoxy-phenyl)methanesulfonamide
SMILES [?]:
CS(=O)(=O)Nc1ccc(cc1Oc2ccccc2)N(=O)=O
InChi [?]:
InChI=1/C13H12N2O5S/c1-21(18,19)14-12-8-7-10(15(16)17)9-13(12)20-11-5-3-2-4-6-11/h2-9,14H,1H3
InChi Info:
AuxInfo=1/0/N:1,16,15,17,14,18,8,7,10,9,13,6,11,5,19,20,21,3,4,12,2/E:(3,4)(5,6)(16,17)(18,19)/CRV:15.5,21.6/rA:21nCSOONCCCCCCOCCCCCCNOO/rB:s1;d2;d2;s2;s5;s6;d7;s8;d9;d6s10;s11;s12;s13;d14;s15;d16;d13s17;s9;d19;d19;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H12N2O5S
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:3.18995
Area:469.591
Solvation:-8.54983
Coulombic:-28.4318
Bond Count [?]
All:22
Single:12
Double:10
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:308.311
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:2.64
LogP (Chemaxon):1.94

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