N-Formyl Dapsone

CAT: 1596-AR-D06449-02Size: 25 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-D06449-02Size:25 Units

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CAS Number

21501-24-6

Synonyms

N- (4- ((4-aminophenyl) sulfonyl) phenyl) formamide

Molecular Formula

C13H12N2O3S

Molecular Weight

276.31

API Name

Dapsone

Chemical Information

N-[4-[(4-Aminophenyl)sulfonyl]phenyl]formamide

CAS Number	21501-24-6
PubChem CID	572763
IUPAC Name	N-[4-(4-aminophenyl)sulfonylphenyl]formamide
Molecular Formula	C13H12N2O3S
Molecular Weight	276.31
XLogP	0.8
Topological Polar Surface Area	97.6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Heavy Atom Count	19
Formal Charge	0
Complexity	389

SMILES

C1=CC(=CC=C1N)S(=O)(=O)C2=CC=C(C=C2)NC=O

InChI

InChI=1S/C13H12N2O3S/c14-10-1-5-12(6-2-10)19(17,18)13-7-3-11(4-8-13)15-9-16/h1-9H,14H2,(H,15,16)

InChIKey

OUBLSNZSHXQKRB-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 21501-24-6

CID: 572763

Formula: C13H12N2O3S

MW: 276.31

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	276.31
XLogP3	0.8
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	276.05686342
Monoisotopic Mass	276.05686342
Topological Polar Surface Area	97.6 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	389
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes