7-[(dimethylamino)methyl]-3-imidazo[2,1-b][1,3]thiazol-6-ylchromen-2-one;7-(4-ethylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-piperidin-4-yloxychromen-2-one;7-(4-propan-2-ylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one;7-(4-propylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one

C105H103N19O11S — CID 161295708

About 7-[(dimethylamino)methyl]-3-imidazo[2,1-b][1,3]thiazol-6-ylchromen-2-one;7-(4-ethylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-piperidin-4-yloxychromen-2-one;7-(4-propan-2-ylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one;7-(4-propylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one

7-[(dimethylamino)methyl]-3-imidazo[2,1-b][1,3]thiazol-6-ylchromen-2-one;7-(4-ethylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-piperidin-4-yloxychromen-2-one;7-(4-propan-2-ylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one;7-(4-propylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one (PubChem CID 161295708) has the molecular formula C105H103N19O11S and a molecular weight of 1839.17 g/mol. Its IUPAC name is 7-[(dimethylamino)methyl]-3-imidazo[2,1-b][1,3]thiazol-6-ylchromen-2-one;7-(4-ethylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-piperidin-4-yloxychromen-2-one;7-(4-propan-2-ylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one;7-(4-propylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one.

Molecular Properties

• Compound Name: 7-[(dimethylamino)methyl]-3-imidazo[2,1-b][1,3]thiazol-6-ylchromen-2-one;7-(4-ethylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-piperidin-4-yloxychromen-2-one;7-(4-propan-2-ylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one;7-(4-propylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one
• PubChem CID: 161295708
• Molecular Formula: C105H103N19O11S
• Molecular Weight: 1839.17 g/mol
• Exact Mass: 1837.78
• IUPAC Name: 7-[(dimethylamino)methyl]-3-imidazo[2,1-b][1,3]thiazol-6-ylchromen-2-one;7-(4-ethylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-piperidin-4-yloxychromen-2-one;7-(4-propan-2-ylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one;7-(4-propylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one
• SMILES: CC(C)N1CCN(c2ccc3cc(-c4cc5ccccn5n4)c(=O)oc3c2)CC1.CCCN1CCN(c2ccc3cc(-c4cc5ccccn5n4)c(=O)oc3c2)CC1.CCN1CCN(c2ccc3cc(-c4cc5ccccn5n4)c(=O)oc3c2)CC1.CN(C)Cc1ccc2cc(-c3cn4ccsc4n3)c(=O)oc2c1.O=c1oc2cc(OC3CCNCC3)ccc2cc1-c1cn2cccnc2n1
• InChI: InChI=1S/2C23H24N4O2.C22H22N4O2.C20H18N4O3.C17H15N3O2S/c1-16(2)25-9-11-26(12-10-25)18-7-6-17-13-20(23(28)29-22(17)15-18)21-14-19-5-3-4-8-27(19)24-21;1-2-8-25-10-12-26(13-11-25)18-7-6-17-14-20(23(28)29-22(17)16-18)21-15-19-5-3-4-9-27(19)24-21;1-2-24-9-11-25(12-10-24)17-7-6-16-13-19(22(27)28-21(16)15-17)20-14-18-5-3-4-8-26(18)23-20;25-19-16(17-12-24-9-1-6-22-20(24)23-17)10-13-2-3-15(11-18(13)27-19)26-14-4-7-21-8-5-14;1-19(2)9-11-3-4-12-8-13(16(21)22-15(12)7-11)14-10-20-5-6-23-17(20)18-14/h3-8,13-16H,9-12H2,1-2H3;3-7,9,14-16H,2,8,10-13H2,1H3;3-8,13-15H,2,9-12H2,1H3;1-3,6,9-12,14,21H,4-5,7-8H2;3-8,10H,9H2,1-2H3
• InChIKey: VGYFAVVNVUGKEH-UHFFFAOYSA-N
• XLogP: 16.39
• TPSA: 294.38 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 31
• Rotatable Bonds: 16
• Heavy Atoms: 136
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1839.17
LogP ≤ 5	16.39
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	31

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'cumarine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 7-[(dimethylamino)methyl]-3-imidazo[2,1-b][1,3]thiazol-6-ylchromen-2-one;7-(4-ethylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-piperidin-4-yloxychromen-2-one;7-(4-propan-2-ylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one;7-(4-propylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one?

The IUPAC name of 7-[(dimethylamino)methyl]-3-imidazo[2,1-b][1,3]thiazol-6-ylchromen-2-one;7-(4-ethylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-piperidin-4-yloxychromen-2-one;7-(4-propan-2-ylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one;7-(4-propylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one (CID 161295708) is 7-[(dimethylamino)methyl]-3-imidazo[2,1-b][1,3]thiazol-6-ylchromen-2-one;7-(4-ethylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-piperidin-4-yloxychromen-2-one;7-(4-propan-2-ylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one;7-(4-propylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one.

What is the SMILES notation for 7-[(dimethylamino)methyl]-3-imidazo[2,1-b][1,3]thiazol-6-ylchromen-2-one;7-(4-ethylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-piperidin-4-yloxychromen-2-one;7-(4-propan-2-ylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one;7-(4-propylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one?

The canonical SMILES for 7-[(dimethylamino)methyl]-3-imidazo[2,1-b][1,3]thiazol-6-ylchromen-2-one;7-(4-ethylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-piperidin-4-yloxychromen-2-one;7-(4-propan-2-ylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one;7-(4-propylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one is CC(C)N1CCN(c2ccc3cc(-c4cc5ccccn5n4)c(=O)oc3c2)CC1.CCCN1CCN(c2ccc3cc(-c4cc5ccccn5n4)c(=O)oc3c2)CC1.CCN1CCN(c2ccc3cc(-c4cc5ccccn5n4)c(=O)oc3c2)CC1.CN(C)Cc1ccc2cc(-c3cn4ccsc4n3)c(=O)oc2c1.O=c1oc2cc(OC3CCNCC3)ccc2cc1-c1cn2cccnc2n1.

What is the InChIKey of 7-[(dimethylamino)methyl]-3-imidazo[2,1-b][1,3]thiazol-6-ylchromen-2-one;7-(4-ethylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-piperidin-4-yloxychromen-2-one;7-(4-propan-2-ylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one;7-(4-propylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one?

The InChIKey is VGYFAVVNVUGKEH-UHFFFAOYSA-N. The full InChI is InChI=1S/2C23H24N4O2.C22H22N4O2.C20H18N4O3.C17H15N3O2S/c1-16(2)25-9-11-26(12-10-25)18-7-6-17-13-20(23(28)29-22(17)15-18)21-14-19-5-3-4-8-27(19)24-21;1-2-8-25-10-12-26(13-11-25)18-7-6-17-14-20(23(28)29-22(17)16-18)21-15-19-5-3-4-9-27(19)24-21;1-2-24-9-11-25(12-10-24)17-7-6-16-13-19(22(27)28-21(16)15-17)20-14-18-5-3-4-8-26(18)23-20;25-19-16(17-12-24-9-1-6-22-20(24)23-17)10-13-2-3-15(11-18(13)27-19)26-14-4-7-21-8-5-14;1-19(2)9-11-3-4-12-8-13(16(21)22-15(12)7-11)14-10-20-5-6-23-17(20)18-14/h3-8,13-16H,9-12H2,1-2H3;3-7,9,14-16H,2,8,10-13H2,1H3;3-8,13-15H,2,9-12H2,1H3;1-3,6,9-12,14,21H,4-5,7-8H2;3-8,10H,9H2,1-2H3.

What are the key properties of 7-[(dimethylamino)methyl]-3-imidazo[2,1-b][1,3]thiazol-6-ylchromen-2-one;7-(4-ethylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-piperidin-4-yloxychromen-2-one;7-(4-propan-2-ylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one;7-(4-propylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one?

7-[(dimethylamino)methyl]-3-imidazo[2,1-b][1,3]thiazol-6-ylchromen-2-one;7-(4-ethylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-piperidin-4-yloxychromen-2-one;7-(4-propan-2-ylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one;7-(4-propylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one has a molecular weight of 1839.17 g/mol, XLogP of 16.39, 16 rotatable bonds, 1 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 7-[(dimethylamino)methyl]-3-imidazo[2,1-b][1,3]thiazol-6-ylchromen-2-one;7-(4-ethylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-piperidin-4-yloxychromen-2-one;7-(4-propan-2-ylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one;7-(4-propylpiperazin-1-yl)-3-pyrazolo[1,5-a]pyridin-2-ylchromen-2-one is sourced from PubChem (CID 161295708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).