AC1LDI3Q

1,3-dimethyl-7-(3-phenylpropyl)-8-(piperidin-1-ylmethyl)purine-2,6-dione

Also Known As: UPCMLD0ENAT5783569:001|NCGC00031135-03|BAS 07401429|AB00426414-09|1,3-dimethyl-7-(3-phenylpropyl)-8-(piperidin-1-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione|F0634-0722|1,3-dimethyl-7-(3-phenylpropyl)-8-(piperidin-1-ylmethyl)purine-2,6-dione|1,3-DI-ME-7-(3-PH-PROPYL)8-(1-PIPERIDINYLMETHYL)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE|1,3-Dimethyl-7-(3-phenyl-propyl)-8-piperidin-1-ylmethyl-3,7-dihydro-purine-2,6-dione|1,3-dimethyl-7-(3-phenylpropyl)-8-(piperidin-1-ylmethyl)-1H-purine-2,6(3H,7H)-dione|1,3-dimethyl-7-(3-phenylpropyl)-8-(piperidylmethyl)-1,3,7-trihydropurine-2,6-d ione|1,3-dimethyl-7-(3-phenylpropyl)-8-[(piperidin-1-yl)methyl]-2,3,6,7-tetrahydro-1H-purine-2,6-dione

Molecular Formula	C22H29N5O2
Molecular Weight	395.23212 g/mol
LogP	2.5
Topological Polar Surface Area	61.7 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	4
Rotatable Bonds	6
Exact Mass	395.23212
Monoisotopic Mass	395.23212
Heavy Atoms	29
Complexity	588.0

Chemical Identifiers

CAS Number	579446-41-6
SMILES	CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CN3CCCCC3)CCCC4=CC=CC=C4
InChIKey	MATNVDGFLMKNBU-UHFFFAOYSA-N