Chemistry:Bromoacetylalprenololmenthane

Bromoacetylalprenololmenthane

Names
IUPAC name 2-bromo-N-[2-[4-[[2-hydroxy-3-(2-prop-2-enylphenoxy)propyl]amino]-4-methylcyclohexyl]propan-2-yl]acetamide
Identifiers
CAS Number	76298-89-0 N 82870-40-4 N
3D model (JSmol)	Interactive image Interactive image
Abbreviations	BAAM, BrAAM
ChEMBL	ChEMBL46136 Y
ChemSpider	112852 Y
MeSH	Bromoacetylalprenololmenthane
PubChem CID	127126
InChI InChI=1S/C24H37BrN2O3/c1-5-8-18-9-6-7-10-21(18)30-17-20(28)16-26-24(4)13-11-19(12-14-24)23(2,3)27-22(29)15-25/h5-7,9-10,19-20,26,28H,1,8,11-17H2,2-4H3,(H,27,29) Y Key: UAXZWLFRPNDCMX-UHFFFAOYSA-N Y InChI=1/C24H37BrN2O3/c1-5-8-18-9-6-7-10-21(18)30-17-20(28)16-26-24(4)13-11-19(12-14-24)23(2,3)27-22(29)15-25/h5-7,9-10,19-20,26,28H,1,8,11-17H2,2-4H3,(H,27,29) Key: UAXZWLFRPNDCMX-UHFFFAOYAY
SMILES CC(C)(NC(=O)CBr)C1CCC(C)(CC1)NCC(O)COC1=CC=CC=C1CC=C BrCC(=O)NC(C2CCC(NCC(O)COc1ccccc1CC=C)(CC2)C)(C)C
Properties
Chemical formula	C24H37BrN2O3
Molar mass	481.475 g·mol−1
log P	4.14
Acidity (pKa)	13.844
Basicity (pKb)	0.153
Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa).
N verify (what is YN ?)
Infobox references

Tracking categories (test):

• SizeSet

Bromoacetylalprenololmenthane (BAAM or BrAAM) is a β adrenergic receptor agonist.