About 7-bromo-2,4-dichloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine;2-bromo-1-fluoro-3-methoxybenzene;tert-butyl (3S)-4-(7-bromo-2-chloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl)-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-4-[7-bromo-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-4-[7-(2-fluoro-6-methoxyphenyl)-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-3-methyl-4-[2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;tert-butyl (3S)-3-methylpiperazine-1-carboxylate;carbanide;[(2S)-1-methylpyrrolidin-2-yl]methanol;palladium(2+);sulfane;2,2,2-trifluoroacetaldehyde
7-bromo-2,4-dichloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine;2-bromo-1-fluoro-3-methoxybenzene;tert-butyl (3S)-4-(7-bromo-2-chloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl)-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-4-[7-bromo-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-4-[7-(2-fluoro-6-methoxyphenyl)-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-3-methyl-4-[2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;tert-butyl (3S)-3-methylpiperazine-1-carboxylate;carbanide;[(2S)-1-methylpyrrolidin-2-yl]methanol;palladium(2+);sulfane;2,2,2-trifluoroacetaldehyde (PubChem CID 162231391) has the molecular formula C127H213Br4Cl3F5N29O17PdS9
and a molecular weight of 3334.27 g/mol. Its IUPAC name is 7-bromo-2,4-dichloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine;2-bromo-1-fluoro-3-methoxybenzene;tert-butyl (3S)-4-(7-bromo-2-chloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl)-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-4-[7-bromo-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-4-[7-(2-fluoro-6-methoxyphenyl)-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-3-methyl-4-[2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;tert-butyl (3S)-3-methylpiperazine-1-carboxylate;carbanide;[(2S)-1-methylpyrrolidin-2-yl]methanol;palladium(2+);sulfane;2,2,2-trifluoroacetaldehyde.
Frequently Asked Questions
What is the IUPAC name of 7-bromo-2,4-dichloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine;2-bromo-1-fluoro-3-methoxybenzene;tert-butyl (3S)-4-(7-bromo-2-chloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl)-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-4-[7-bromo-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-4-[7-(2-fluoro-6-methoxyphenyl)-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-3-methyl-4-[2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;tert-butyl (3S)-3-methylpiperazine-1-carboxylate;carbanide;[(2S)-1-methylpyrrolidin-2-yl]methanol;palladium(2+);sulfane;2,2,2-trifluoroacetaldehyde?
The IUPAC name of 7-bromo-2,4-dichloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine;2-bromo-1-fluoro-3-methoxybenzene;tert-butyl (3S)-4-(7-bromo-2-chloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl)-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-4-[7-bromo-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-4-[7-(2-fluoro-6-methoxyphenyl)-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-3-methyl-4-[2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;tert-butyl (3S)-3-methylpiperazine-1-carboxylate;carbanide;[(2S)-1-methylpyrrolidin-2-yl]methanol;palladium(2+);sulfane;2,2,2-trifluoroacetaldehyde (CID 162231391) is 7-bromo-2,4-dichloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine;2-bromo-1-fluoro-3-methoxybenzene;tert-butyl (3S)-4-(7-bromo-2-chloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl)-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-4-[7-bromo-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-4-[7-(2-fluoro-6-methoxyphenyl)-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-3-methyl-4-[2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;tert-butyl (3S)-3-methylpiperazine-1-carboxylate;carbanide;[(2S)-1-methylpyrrolidin-2-yl]methanol;palladium(2+);sulfane;2,2,2-trifluoroacetaldehyde.
What is the SMILES notation for 7-bromo-2,4-dichloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine;2-bromo-1-fluoro-3-methoxybenzene;tert-butyl (3S)-4-(7-bromo-2-chloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl)-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-4-[7-bromo-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-4-[7-(2-fluoro-6-methoxyphenyl)-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-3-methyl-4-[2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;tert-butyl (3S)-3-methylpiperazine-1-carboxylate;carbanide;[(2S)-1-methylpyrrolidin-2-yl]methanol;palladium(2+);sulfane;2,2,2-trifluoroacetaldehyde?
The canonical SMILES for 7-bromo-2,4-dichloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine;2-bromo-1-fluoro-3-methoxybenzene;tert-butyl (3S)-4-(7-bromo-2-chloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl)-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-4-[7-bromo-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-4-[7-(2-fluoro-6-methoxyphenyl)-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-3-methyl-4-[2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;tert-butyl (3S)-3-methylpiperazine-1-carboxylate;carbanide;[(2S)-1-methylpyrrolidin-2-yl]methanol;palladium(2+);sulfane;2,2,2-trifluoroacetaldehyde is CN1CCC[C@H]1CO.COc1cccc(F)c1Br.COc1cccc(F)c1N1CCc2c(nc(OC[C@@H]3CCCN3C)nc2N2CCN(C(=O)OC(C)(C)C)C[C@@H]2C)C1.C[C@H]1CN(C(=O)OC(C)(C)C)CCN1.C[C@H]1CN(C(=O)OC(C)(C)C)CCN1c1nc(Cl)nc2c1CCN(Br)C2.C[C@H]1CN(C(=O)OC(C)(C)C)CCN1c1nc(OC[C@@H]2CCCN2C)nc2c1CCN(Br)C2.C[C@H]1CN(C(=O)OC(C)(C)C)CCN1c1nc(OC[C@@H]2CCCN2C)nc2c1CCNC2.Clc1nc(Cl)c2c(n1)CN(Br)CC2.O=CC(F)(F)F.S.S.S.S.S.S.S.S.S.[CH3-].[CH3-].[Pd+2].
What is the InChIKey of 7-bromo-2,4-dichloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine;2-bromo-1-fluoro-3-methoxybenzene;tert-butyl (3S)-4-(7-bromo-2-chloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl)-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-4-[7-bromo-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-4-[7-(2-fluoro-6-methoxyphenyl)-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-3-methyl-4-[2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;tert-butyl (3S)-3-methylpiperazine-1-carboxylate;carbanide;[(2S)-1-methylpyrrolidin-2-yl]methanol;palladium(2+);sulfane;2,2,2-trifluoroacetaldehyde?
The InChIKey is ZVMBMDXQQZZNDQ-XAOPYJKLSA-N. The full InChI is InChI=1S/C30H43FN6O4.C23H37BrN6O3.C23H38N6O3.C17H25BrClN5O2.C10H20N2O2.C7H6BrCl2N3.C7H6BrFO.C6H13NO.C2HF3O.2CH3.Pd.9H2S/c1-20-17-36(29(38)41-30(2,3)4)15-16-37(20)27-22-12-14-35(26-23(31)10-7-11-25(26)39-6)18-24(22)32-28(33-27)40-19-21-9-8-13-34(21)5;1-16-13-28(22(31)33-23(2,3)4)11-12-30(16)20-18-8-10-29(24)14-19(18)25-21(26-20)32-15-17-7-6-9-27(17)5;1-16-14-28(22(30)32-23(2,3)4)11-12-29(16)20-18-8-9-24-13-19(18)25-21(26-20)31-15-17-7-6-10-27(17)5;1-11-9-22(16(25)26-17(2,3)4)7-8-24(11)14-12-5-6-23(18)10-13(12)20-15(19)21-14;1-8-7-12(6-5-11-8)9(13)14-10(2,3)4;8-13-2-1-4-5(3-13)11-7(10)12-6(4)9;1-10-6-4-2-3-5(9)7(6)8;1-7-4-2-3-6(7)5-8;3-2(4,5)1-6;;;;;;;;;;;;/h7,10-11,20-21H,8-9,12-19H2,1-6H3;16-17H,6-15H2,1-5H3;16-17,24H,6-15H2,1-5H3;11H,5-10H2,1-4H3;8,11H,5-7H2,1-4H3;1-3H2;2-4H,1H3;6,8H,2-5H2,1H3;1H;2*1H3;;9*1H2/q;;;;;;;;;2*-1;+2;;;;;;;;;/t20-,21-;2*16-,17-;11-;8-;;;6-;;;;;;;;;;;;;/m00000..0............./s1.
What are the key properties of 7-bromo-2,4-dichloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine;2-bromo-1-fluoro-3-methoxybenzene;tert-butyl (3S)-4-(7-bromo-2-chloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl)-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-4-[7-bromo-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-4-[7-(2-fluoro-6-methoxyphenyl)-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-3-methyl-4-[2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;tert-butyl (3S)-3-methylpiperazine-1-carboxylate;carbanide;[(2S)-1-methylpyrrolidin-2-yl]methanol;palladium(2+);sulfane;2,2,2-trifluoroacetaldehyde?
7-bromo-2,4-dichloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine;2-bromo-1-fluoro-3-methoxybenzene;tert-butyl (3S)-4-(7-bromo-2-chloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl)-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-4-[7-bromo-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-4-[7-(2-fluoro-6-methoxyphenyl)-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-3-methyl-4-[2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;tert-butyl (3S)-3-methylpiperazine-1-carboxylate;carbanide;[(2S)-1-methylpyrrolidin-2-yl]methanol;palladium(2+);sulfane;2,2,2-trifluoroacetaldehyde has a molecular weight of 3334.27 g/mol, XLogP of 21.45, 17 rotatable bonds, 3 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-2,4-dichloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine;2-bromo-1-fluoro-3-methoxybenzene;tert-butyl (3S)-4-(7-bromo-2-chloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl)-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-4-[7-bromo-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-4-[7-(2-fluoro-6-methoxyphenyl)-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-3-methyl-4-[2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl]piperazine-1-carboxylate;tert-butyl (3S)-3-methylpiperazine-1-carboxylate;carbanide;[(2S)-1-methylpyrrolidin-2-yl]methanol;palladium(2+);sulfane;2,2,2-trifluoroacetaldehyde is sourced from PubChem (CID 162231391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).