About tert-butyl 4-[7-(3-methoxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;tert-butyl 4-[2-(3-morpholin-4-ylpropoxy)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;1-[4-[7-(3-hydroxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;1-[4-[7-(3-methoxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;4-[3-[[7-(3-methoxy-2-methylnaphthalen-1-yl)-4-piperidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-yl]oxy]propyl]morpholine;(3-methoxy-2-methylnaphthalen-1-yl) trifluoromethanesulfonate;prop-2-enoyl prop-2-enoate
tert-butyl 4-[7-(3-methoxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;tert-butyl 4-[2-(3-morpholin-4-ylpropoxy)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;1-[4-[7-(3-hydroxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;1-[4-[7-(3-methoxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;4-[3-[[7-(3-methoxy-2-methylnaphthalen-1-yl)-4-piperidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-yl]oxy]propyl]morpholine;(3-methoxy-2-methylnaphthalen-1-yl) trifluoromethanesulfonate;prop-2-enoyl prop-2-enoate (PubChem CID 160793702) has the molecular formula C173H226F3N29O27S
and a molecular weight of 3232.95 g/mol. Its IUPAC name is tert-butyl 4-[7-(3-methoxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;tert-butyl 4-[2-(3-morpholin-4-ylpropoxy)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;1-[4-[7-(3-hydroxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;1-[4-[7-(3-methoxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;4-[3-[[7-(3-methoxy-2-methylnaphthalen-1-yl)-4-piperidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-yl]oxy]propyl]morpholine;(3-methoxy-2-methylnaphthalen-1-yl) trifluoromethanesulfonate;prop-2-enoyl prop-2-enoate.
Frequently Asked Questions
What is the IUPAC name of tert-butyl 4-[7-(3-methoxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;tert-butyl 4-[2-(3-morpholin-4-ylpropoxy)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;1-[4-[7-(3-hydroxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;1-[4-[7-(3-methoxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;4-[3-[[7-(3-methoxy-2-methylnaphthalen-1-yl)-4-piperidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-yl]oxy]propyl]morpholine;(3-methoxy-2-methylnaphthalen-1-yl) trifluoromethanesulfonate;prop-2-enoyl prop-2-enoate?
The IUPAC name of tert-butyl 4-[7-(3-methoxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;tert-butyl 4-[2-(3-morpholin-4-ylpropoxy)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;1-[4-[7-(3-hydroxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;1-[4-[7-(3-methoxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;4-[3-[[7-(3-methoxy-2-methylnaphthalen-1-yl)-4-piperidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-yl]oxy]propyl]morpholine;(3-methoxy-2-methylnaphthalen-1-yl) trifluoromethanesulfonate;prop-2-enoyl prop-2-enoate (CID 160793702) is tert-butyl 4-[7-(3-methoxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;tert-butyl 4-[2-(3-morpholin-4-ylpropoxy)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;1-[4-[7-(3-hydroxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;1-[4-[7-(3-methoxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;4-[3-[[7-(3-methoxy-2-methylnaphthalen-1-yl)-4-piperidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-yl]oxy]propyl]morpholine;(3-methoxy-2-methylnaphthalen-1-yl) trifluoromethanesulfonate;prop-2-enoyl prop-2-enoate.
What is the SMILES notation for tert-butyl 4-[7-(3-methoxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;tert-butyl 4-[2-(3-morpholin-4-ylpropoxy)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;1-[4-[7-(3-hydroxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;1-[4-[7-(3-methoxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;4-[3-[[7-(3-methoxy-2-methylnaphthalen-1-yl)-4-piperidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-yl]oxy]propyl]morpholine;(3-methoxy-2-methylnaphthalen-1-yl) trifluoromethanesulfonate;prop-2-enoyl prop-2-enoate?
The canonical SMILES for tert-butyl 4-[7-(3-methoxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;tert-butyl 4-[2-(3-morpholin-4-ylpropoxy)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;1-[4-[7-(3-hydroxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;1-[4-[7-(3-methoxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;4-[3-[[7-(3-methoxy-2-methylnaphthalen-1-yl)-4-piperidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-yl]oxy]propyl]morpholine;(3-methoxy-2-methylnaphthalen-1-yl) trifluoromethanesulfonate;prop-2-enoyl prop-2-enoate is C=CC(=O)N1CCN(c2nc(OCCCN3CCOCC3)nc3c2CCN(c2c(C)c(O)cc4ccccc24)C3)CC1.C=CC(=O)N1CCN(c2nc(OCCCN3CCOCC3)nc3c2CCN(c2c(C)c(OC)cc4ccccc24)C3)CC1.C=CC(=O)OC(=O)C=C.CC(C)(C)OC(=O)N1CCN(c2nc(OCCCN3CCOCC3)nc3c2CCNC3)CC1.COc1cc2ccccc2c(N2CCc3c(nc(OCCCN4CCOCC4)nc3N3CCCCC3)C2)c1C.COc1cc2ccccc2c(N2CCc3c(nc(OCCCN4CCOCC4)nc3N3CCN(C(=O)OC(C)(C)C)CC3)C2)c1C.COc1cc2ccccc2c(OS(=O)(=O)C(F)(F)F)c1C.
What is the InChIKey of tert-butyl 4-[7-(3-methoxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;tert-butyl 4-[2-(3-morpholin-4-ylpropoxy)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;1-[4-[7-(3-hydroxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;1-[4-[7-(3-methoxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;4-[3-[[7-(3-methoxy-2-methylnaphthalen-1-yl)-4-piperidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-yl]oxy]propyl]morpholine;(3-methoxy-2-methylnaphthalen-1-yl) trifluoromethanesulfonate;prop-2-enoyl prop-2-enoate?
The InChIKey is SCDSPFDHOPFFDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H48N6O5.C33H42N6O4.C32H40N6O4.C31H41N5O3.C23H38N6O4.C13H11F3O4S.C6H6O3/c1-25-30(43-5)23-26-9-6-7-10-27(26)31(25)41-13-11-28-29(24-41)36-33(45-20-8-12-38-18-21-44-22-19-38)37-32(28)39-14-16-40(17-15-39)34(42)46-35(2,3)4;1-4-30(40)37-13-15-38(16-14-37)32-27-10-12-39(31-24(2)29(41-3)22-25-8-5-6-9-26(25)31)23-28(27)34-33(35-32)43-19-7-11-36-17-20-42-21-18-36;1-3-29(40)36-12-14-37(15-13-36)31-26-9-11-38(30-23(2)28(39)21-24-7-4-5-8-25(24)30)22-27(26)33-32(34-31)42-18-6-10-35-16-19-41-20-17-35;1-23-28(37-2)21-24-9-4-5-10-25(24)29(23)36-15-11-26-27(22-36)32-31(33-30(26)35-13-6-3-7-14-35)39-18-8-12-34-16-19-38-20-17-34;1-23(2,3)33-22(30)29-10-8-28(9-11-29)20-18-5-6-24-17-19(18)25-21(26-20)32-14-4-7-27-12-15-31-16-13-27;1-8-11(19-2)7-9-5-3-4-6-10(9)12(8)20-21(17,18)13(14,15)16;1-3-5(7)9-6(8)4-2/h6-7,9-10,23H,8,11-22,24H2,1-5H3;4-6,8-9,22H,1,7,10-21,23H2,2-3H3;3-5,7-8,21,39H,1,6,9-20,22H2,2H3;4-5,9-10,21H,3,6-8,11-20,22H2,1-2H3;24H,4-17H2,1-3H3;3-7H,1-2H3;3-4H,1-2H2.
What are the key properties of tert-butyl 4-[7-(3-methoxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;tert-butyl 4-[2-(3-morpholin-4-ylpropoxy)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;1-[4-[7-(3-hydroxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;1-[4-[7-(3-methoxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;4-[3-[[7-(3-methoxy-2-methylnaphthalen-1-yl)-4-piperidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-yl]oxy]propyl]morpholine;(3-methoxy-2-methylnaphthalen-1-yl) trifluoromethanesulfonate;prop-2-enoyl prop-2-enoate?
tert-butyl 4-[7-(3-methoxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;tert-butyl 4-[2-(3-morpholin-4-ylpropoxy)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;1-[4-[7-(3-hydroxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;1-[4-[7-(3-methoxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;4-[3-[[7-(3-methoxy-2-methylnaphthalen-1-yl)-4-piperidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-yl]oxy]propyl]morpholine;(3-methoxy-2-methylnaphthalen-1-yl) trifluoromethanesulfonate;prop-2-enoyl prop-2-enoate has a molecular weight of 3232.95 g/mol, XLogP of 20.95, 44 rotatable bonds, 2 hydrogen bond donors, and 52 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 4-[7-(3-methoxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;tert-butyl 4-[2-(3-morpholin-4-ylpropoxy)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;1-[4-[7-(3-hydroxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;1-[4-[7-(3-methoxy-2-methylnaphthalen-1-yl)-2-(3-morpholin-4-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;4-[3-[[7-(3-methoxy-2-methylnaphthalen-1-yl)-4-piperidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-yl]oxy]propyl]morpholine;(3-methoxy-2-methylnaphthalen-1-yl) trifluoromethanesulfonate;prop-2-enoyl prop-2-enoate is sourced from PubChem (CID 160793702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).