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Chemical ID: 7202507

Chemical ID:

7202507

Name [?]:

2-(benzenesulfonamido)-N-benzylideneamino-acetamide

SMILES [?]:

c1ccc(cc1)C=NNC(=O)CNS(=O)(=O)c2ccccc2

InChi [?]:

InChI=1/C15H15N3O3S/c19-15(18-16-11-13-7-3-1-4-8-13)12-17-22(20,21)14-9-5-2-6-10-14/h1-11,17H,12H2,(H,18,19)

InChi Info:

AuxInfo=1/1/N:1,20,2,6,19,21,3,5,18,22,7,12,4,17,10,8,13,9,11,15,16,14/E:(3,4)(5,6)(7,8)(9,10)(20,21)/CRV:22.6/rA:22nCCCCCCCNNCOCNSOOCCCCCC/rB:s1;d2;s3;d4;d1s5;s4;w7;s8;s9;d10;s10;s12;s13;d14;d14;s14;s17;d18;s19;d20;d17s21;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₅H₁₅N₃O₃S
All Atoms:	37
Heavy Atoms:	22
Chiral Atoms:	0

ZAP Information [?]

Total:	8.62333
Area:	524.197
Solvation:	-4.48159
Coulombic:	-31.6686

Bond Count [?]

All:	23
Single:	13
Double:	10
Rotors:	7
Chiral:	1
Rigid Segments:	6

Chemical Properties

Molecular Weight:	317.364
H-Bond Donors:	2
H-Bond Acceptors:	6
XLogP:	2.61
LogP (Chemaxon):	2.15

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