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AP-906/42711842 is available in 110 mg

Compound details
MDL #:		MFCD05741347
Formula:		C15 H16 Br N3 O3 S
Weight:		398.28
Chiral info:		Not available
Name:		5-bromo-N-{4-[(propylamino)sulfonyl]phenyl}nicotinamide
SMILES:		CCCNS(=O)(=O)c1ccc(cc1)NC(=O)c2cncc(c2)Br
InChI^TM:		InChI=1S/C15H16BrN3O3S/c1-2-7-18-23(21,22)14-5-3-13(4-6-14)19-15(20)11-8-12(16)10-17-9-11/h3-6,8-10,18H,2,7H2,1H3,(H,19,20)
InChIKey^TM:		FTDXAKPYXFKHAV-UHFFFAOYSA-N

Toxicity predictions
Rat Oral LD₅₀:		1900 mg/Kg
Chronic LOAEL:		44.9 mg/Kg
Developmental Toxicity Potential:		1

Chemical properties calculations
LogP:	2.93	H-acceptors: 6
LogS:	-4.6	H-donors: 2
tPSA:	96.54 Å²	Rotatable bonds: 7

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Disclaimer: Predicted physical and biological properties, such as toxicity, mentioned on this website are indicative only and may not be relied upon in any way. Liability for damages of any kind resulting from reliance on these properties is expressly rejected.