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Chemical ID: 7284328

Chemical ID:

7284328

Name [?]:

N-(3,5-dimethoxyphenyl)-2-methoxy-benzenesulfonamide

SMILES [?]:

COc1ccccc1S(=O)(=O)Nc2cc(cc(c2)OC)OC

InChi [?]:

InChI=1/C15H17NO5S/c1-19-12-8-11(9-13(10-12)20-2)16-22(17,18)15-7-5-4-6-14(15)21-3/h4-10,16H,1-3H3

InChi Info:

AuxInfo=1/0/N:20,22,1,5,6,4,7,18,14,16,13,17,15,3,8,12,10,11,19,21,2,9/E:(1,2)(8,9)(12,13)(17,18)(19,20)/CRV:22.6/rA:22nCOCCCCCCSOONCCCCCCOCOC/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;d9;d9;s9;s12;s13;d14;s15;d16;d13s17;s17;s19;s15;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₅H₁₇NO₅S
All Atoms:	39
Heavy Atoms:	22
Chiral Atoms:	0

ZAP Information [?]

Total:	6.44255
Area:	490.424
Solvation:	-5.81805
Coulombic:	-33.0944

Bond Count [?]

All:	23
Single:	15
Double:	8
Rotors:	6
Chiral:	0
Rigid Segments:	6

Chemical Properties

Molecular Weight:	323.365
H-Bond Donors:	1
H-Bond Acceptors:	6
XLogP:	2.46
LogP (Chemaxon):	1.85

Name Annotations

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Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

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Descriptor Annotations

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Chemical Mix	Source	External ID	Descriptor	Value