3-[[4-(3a,7a-dihydro-1H-indol-5-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one;bis(3-[[4-(7H-cyclopenta[b]pyridin-3-yl)phenyl]methyl]quinazolin-4-one);3-[(4-imidazo[1,2-a]pyridin-3-ylphenyl)methyl]quinazolin-4-one;3-[(4-imidazo[1,2-a]pyridin-6-ylphenyl)methyl]quinazolin-4-one;3-[(4-indolizin-6-ylphenyl)methyl]quinazolin-4-one;3-[[4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one;3-[[4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one

C180H136N30O8 — CID 159344598

About 3-[[4-(3a,7a-dihydro-1H-indol-5-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one;bis(3-[[4-(7H-cyclopenta[b]pyridin-3-yl)phenyl]methyl]quinazolin-4-one);3-[(4-imidazo[1,2-a]pyridin-3-ylphenyl)methyl]quinazolin-4-one;3-[(4-imidazo[1,2-a]pyridin-6-ylphenyl)methyl]quinazolin-4-one;3-[(4-indolizin-6-ylphenyl)methyl]quinazolin-4-one;3-[[4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one;3-[[4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one

3-[[4-(3a,7a-dihydro-1H-indol-5-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one;bis(3-[[4-(7H-cyclopenta[b]pyridin-3-yl)phenyl]methyl]quinazolin-4-one);3-[(4-imidazo[1,2-a]pyridin-3-ylphenyl)methyl]quinazolin-4-one;3-[(4-imidazo[1,2-a]pyridin-6-ylphenyl)methyl]quinazolin-4-one;3-[(4-indolizin-6-ylphenyl)methyl]quinazolin-4-one;3-[[4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one;3-[[4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one (PubChem CID 159344598) has the molecular formula C180H136N30O8 and a molecular weight of 2847.27 g/mol. Its IUPAC name is 3-[[4-(3a,7a-dihydro-1H-indol-5-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one;bis(3-[[4-(7H-cyclopenta[b]pyridin-3-yl)phenyl]methyl]quinazolin-4-one);3-[(4-imidazo[1,2-a]pyridin-3-ylphenyl)methyl]quinazolin-4-one;3-[(4-imidazo[1,2-a]pyridin-6-ylphenyl)methyl]quinazolin-4-one;3-[(4-indolizin-6-ylphenyl)methyl]quinazolin-4-one;3-[[4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one;3-[[4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one.

Molecular Properties

• Compound Name: 3-[[4-(3a,7a-dihydro-1H-indol-5-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one;bis(3-[[4-(7H-cyclopenta[b]pyridin-3-yl)phenyl]methyl]quinazolin-4-one);3-[(4-imidazo[1,2-a]pyridin-3-ylphenyl)methyl]quinazolin-4-one;3-[(4-imidazo[1,2-a]pyridin-6-ylphenyl)methyl]quinazolin-4-one;3-[(4-indolizin-6-ylphenyl)methyl]quinazolin-4-one;3-[[4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one;3-[[4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one
• PubChem CID: 159344598
• Molecular Formula: C180H136N30O8
• Molecular Weight: 2847.27 g/mol
• Exact Mass: 2845.12
• IUPAC Name: 3-[[4-(3a,7a-dihydro-1H-indol-5-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one;bis(3-[[4-(7H-cyclopenta[b]pyridin-3-yl)phenyl]methyl]quinazolin-4-one);3-[(4-imidazo[1,2-a]pyridin-3-ylphenyl)methyl]quinazolin-4-one;3-[(4-imidazo[1,2-a]pyridin-6-ylphenyl)methyl]quinazolin-4-one;3-[(4-indolizin-6-ylphenyl)methyl]quinazolin-4-one;3-[[4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one;3-[[4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one
• SMILES: Cn1cc2cc(-c3ccc(Cn4cnc5ncccc5c4=O)cc3)ccc2n1.Cn1cc2cccc(-c3ccc(Cn4cnc5ncccc5c4=O)cc3)c2c1.O=c1c2ccccc2ncn1Cc1ccc(-c2ccc3cccn3c2)cc1.O=c1c2ccccc2ncn1Cc1ccc(-c2ccc3nccn3c2)cc1.O=c1c2ccccc2ncn1Cc1ccc(-c2cnc3c(c2)C=CC3)cc1.O=c1c2ccccc2ncn1Cc1ccc(-c2cnc3c(c2)C=CC3)cc1.O=c1c2ccccc2ncn1Cc1ccc(-c2cnc3ccccn23)cc1.O=c1c2cccnc2ncn1Cc1ccc(C2=CC3C=CNC3C=C2)cc1
• InChI: InChI=1S/C23H18N4O.3C23H17N3O.C22H17N5O.C22H18N4O.2C22H16N4O/c1-26-13-18-4-2-5-19(21(18)14-26)17-9-7-16(8-10-17)12-27-15-25-22-20(23(27)28)6-3-11-24-22;27-23-21-5-1-2-6-22(21)24-16-26(23)14-17-7-9-18(10-8-17)19-11-12-20-4-3-13-25(20)15-19;2*27-23-20-5-1-2-6-22(20)25-15-26(23)14-16-8-10-17(11-9-16)19-12-18-4-3-7-21(18)24-13-19;1-26-13-18-11-17(8-9-20(18)25-26)16-6-4-15(5-7-16)12-27-14-24-21-19(22(27)28)3-2-10-23-21;27-22-19-2-1-10-24-21(19)25-14-26(22)13-15-3-5-16(6-4-15)17-7-8-20-18(12-17)9-11-23-20;27-22-18-5-1-2-6-19(18)24-15-25(22)14-16-8-10-17(11-9-16)20-13-23-21-7-3-4-12-26(20)21;27-22-19-3-1-2-4-20(19)24-15-26(22)13-16-5-7-17(8-6-16)18-9-10-21-23-11-12-25(21)14-18/h2-11,13-15H,12H2,1H3;1-13,15-16H,14H2;2*1-6,8-13,15H,7,14H2;2-11,13-14H,12H2,1H3;1-12,14,18,20,23H,13H2;1-13,15H,14H2;1-12,14-15H,13H2
• InChIKey: LGOFDMXYSIYJEG-UHFFFAOYSA-N
• XLogP: 30.32
• TPSA: 417.36 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 38
• Rotatable Bonds: 24
• Heavy Atoms: 218
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2847.27
LogP ≤ 5	30.32
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	38

Frequently Asked Questions

What is the IUPAC name of 3-[[4-(3a,7a-dihydro-1H-indol-5-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one;bis(3-[[4-(7H-cyclopenta[b]pyridin-3-yl)phenyl]methyl]quinazolin-4-one);3-[(4-imidazo[1,2-a]pyridin-3-ylphenyl)methyl]quinazolin-4-one;3-[(4-imidazo[1,2-a]pyridin-6-ylphenyl)methyl]quinazolin-4-one;3-[(4-indolizin-6-ylphenyl)methyl]quinazolin-4-one;3-[[4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one;3-[[4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one?

The IUPAC name of 3-[[4-(3a,7a-dihydro-1H-indol-5-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one;bis(3-[[4-(7H-cyclopenta[b]pyridin-3-yl)phenyl]methyl]quinazolin-4-one);3-[(4-imidazo[1,2-a]pyridin-3-ylphenyl)methyl]quinazolin-4-one;3-[(4-imidazo[1,2-a]pyridin-6-ylphenyl)methyl]quinazolin-4-one;3-[(4-indolizin-6-ylphenyl)methyl]quinazolin-4-one;3-[[4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one;3-[[4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one (CID 159344598) is 3-[[4-(3a,7a-dihydro-1H-indol-5-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one;bis(3-[[4-(7H-cyclopenta[b]pyridin-3-yl)phenyl]methyl]quinazolin-4-one);3-[(4-imidazo[1,2-a]pyridin-3-ylphenyl)methyl]quinazolin-4-one;3-[(4-imidazo[1,2-a]pyridin-6-ylphenyl)methyl]quinazolin-4-one;3-[(4-indolizin-6-ylphenyl)methyl]quinazolin-4-one;3-[[4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one;3-[[4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one.

What is the SMILES notation for 3-[[4-(3a,7a-dihydro-1H-indol-5-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one;bis(3-[[4-(7H-cyclopenta[b]pyridin-3-yl)phenyl]methyl]quinazolin-4-one);3-[(4-imidazo[1,2-a]pyridin-3-ylphenyl)methyl]quinazolin-4-one;3-[(4-imidazo[1,2-a]pyridin-6-ylphenyl)methyl]quinazolin-4-one;3-[(4-indolizin-6-ylphenyl)methyl]quinazolin-4-one;3-[[4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one;3-[[4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one?

The canonical SMILES for 3-[[4-(3a,7a-dihydro-1H-indol-5-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one;bis(3-[[4-(7H-cyclopenta[b]pyridin-3-yl)phenyl]methyl]quinazolin-4-one);3-[(4-imidazo[1,2-a]pyridin-3-ylphenyl)methyl]quinazolin-4-one;3-[(4-imidazo[1,2-a]pyridin-6-ylphenyl)methyl]quinazolin-4-one;3-[(4-indolizin-6-ylphenyl)methyl]quinazolin-4-one;3-[[4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one;3-[[4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one is Cn1cc2cc(-c3ccc(Cn4cnc5ncccc5c4=O)cc3)ccc2n1.Cn1cc2cccc(-c3ccc(Cn4cnc5ncccc5c4=O)cc3)c2c1.O=c1c2ccccc2ncn1Cc1ccc(-c2ccc3cccn3c2)cc1.O=c1c2ccccc2ncn1Cc1ccc(-c2ccc3nccn3c2)cc1.O=c1c2ccccc2ncn1Cc1ccc(-c2cnc3c(c2)C=CC3)cc1.O=c1c2ccccc2ncn1Cc1ccc(-c2cnc3c(c2)C=CC3)cc1.O=c1c2ccccc2ncn1Cc1ccc(-c2cnc3ccccn23)cc1.O=c1c2cccnc2ncn1Cc1ccc(C2=CC3C=CNC3C=C2)cc1.

What is the InChIKey of 3-[[4-(3a,7a-dihydro-1H-indol-5-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one;bis(3-[[4-(7H-cyclopenta[b]pyridin-3-yl)phenyl]methyl]quinazolin-4-one);3-[(4-imidazo[1,2-a]pyridin-3-ylphenyl)methyl]quinazolin-4-one;3-[(4-imidazo[1,2-a]pyridin-6-ylphenyl)methyl]quinazolin-4-one;3-[(4-indolizin-6-ylphenyl)methyl]quinazolin-4-one;3-[[4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one;3-[[4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one?

The InChIKey is LGOFDMXYSIYJEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N4O.3C23H17N3O.C22H17N5O.C22H18N4O.2C22H16N4O/c1-26-13-18-4-2-5-19(21(18)14-26)17-9-7-16(8-10-17)12-27-15-25-22-20(23(27)28)6-3-11-24-22;27-23-21-5-1-2-6-22(21)24-16-26(23)14-17-7-9-18(10-8-17)19-11-12-20-4-3-13-25(20)15-19;2*27-23-20-5-1-2-6-22(20)25-15-26(23)14-16-8-10-17(11-9-16)19-12-18-4-3-7-21(18)24-13-19;1-26-13-18-11-17(8-9-20(18)25-26)16-6-4-15(5-7-16)12-27-14-24-21-19(22(27)28)3-2-10-23-21;27-22-19-2-1-10-24-21(19)25-14-26(22)13-15-3-5-16(6-4-15)17-7-8-20-18(12-17)9-11-23-20;27-22-18-5-1-2-6-19(18)24-15-25(22)14-16-8-10-17(11-9-16)20-13-23-21-7-3-4-12-26(20)21;27-22-19-3-1-2-4-20(19)24-15-26(22)13-16-5-7-17(8-6-16)18-9-10-21-23-11-12-25(21)14-18/h2-11,13-15H,12H2,1H3;1-13,15-16H,14H2;2*1-6,8-13,15H,7,14H2;2-11,13-14H,12H2,1H3;1-12,14,18,20,23H,13H2;1-13,15H,14H2;1-12,14-15H,13H2.

What are the key properties of 3-[[4-(3a,7a-dihydro-1H-indol-5-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one;bis(3-[[4-(7H-cyclopenta[b]pyridin-3-yl)phenyl]methyl]quinazolin-4-one);3-[(4-imidazo[1,2-a]pyridin-3-ylphenyl)methyl]quinazolin-4-one;3-[(4-imidazo[1,2-a]pyridin-6-ylphenyl)methyl]quinazolin-4-one;3-[(4-indolizin-6-ylphenyl)methyl]quinazolin-4-one;3-[[4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one;3-[[4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one?

3-[[4-(3a,7a-dihydro-1H-indol-5-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one;bis(3-[[4-(7H-cyclopenta[b]pyridin-3-yl)phenyl]methyl]quinazolin-4-one);3-[(4-imidazo[1,2-a]pyridin-3-ylphenyl)methyl]quinazolin-4-one;3-[(4-imidazo[1,2-a]pyridin-6-ylphenyl)methyl]quinazolin-4-one;3-[(4-indolizin-6-ylphenyl)methyl]quinazolin-4-one;3-[[4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one;3-[[4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one has a molecular weight of 2847.27 g/mol, XLogP of 30.32, 24 rotatable bonds, 1 hydrogen bond donors, and 38 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[[4-(3a,7a-dihydro-1H-indol-5-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one;bis(3-[[4-(7H-cyclopenta[b]pyridin-3-yl)phenyl]methyl]quinazolin-4-one);3-[(4-imidazo[1,2-a]pyridin-3-ylphenyl)methyl]quinazolin-4-one;3-[(4-imidazo[1,2-a]pyridin-6-ylphenyl)methyl]quinazolin-4-one;3-[(4-indolizin-6-ylphenyl)methyl]quinazolin-4-one;3-[[4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one;3-[[4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[2,3-d]pyrimidin-4-one is sourced from PubChem (CID 159344598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).