7-(2,3-dihydroindol-1-yl)-N-(2,3-dihydroxypropyl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(2,3-dihydroindol-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(5-fluoro-3,3-dimethyl-2H-indol-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(5-fluorospiro[2H-indole-3,1'-cyclopropane]-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-[3-(hydroxymethyl)-2,3-dihydroindol-1-yl]-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;N-(oxan-4-yl)-7-spiro[2H-indole-3,4'-oxane]-1-yl-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide

C121H124F2N30O15S6 — CID 157256134

About 7-(2,3-dihydroindol-1-yl)-N-(2,3-dihydroxypropyl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(2,3-dihydroindol-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(5-fluoro-3,3-dimethyl-2H-indol-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(5-fluorospiro[2H-indole-3,1'-cyclopropane]-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-[3-(hydroxymethyl)-2,3-dihydroindol-1-yl]-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;N-(oxan-4-yl)-7-spiro[2H-indole-3,4'-oxane]-1-yl-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide

7-(2,3-dihydroindol-1-yl)-N-(2,3-dihydroxypropyl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(2,3-dihydroindol-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(5-fluoro-3,3-dimethyl-2H-indol-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(5-fluorospiro[2H-indole-3,1'-cyclopropane]-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-[3-(hydroxymethyl)-2,3-dihydroindol-1-yl]-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;N-(oxan-4-yl)-7-spiro[2H-indole-3,4'-oxane]-1-yl-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide (PubChem CID 157256134) has the molecular formula C121H124F2N30O15S6 and a molecular weight of 2468.92 g/mol. Its IUPAC name is 7-(2,3-dihydroindol-1-yl)-N-(2,3-dihydroxypropyl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(2,3-dihydroindol-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(5-fluoro-3,3-dimethyl-2H-indol-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(5-fluorospiro[2H-indole-3,1'-cyclopropane]-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-[3-(hydroxymethyl)-2,3-dihydroindol-1-yl]-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;N-(oxan-4-yl)-7-spiro[2H-indole-3,4'-oxane]-1-yl-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide.

Molecular Properties

• Compound Name: 7-(2,3-dihydroindol-1-yl)-N-(2,3-dihydroxypropyl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(2,3-dihydroindol-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(5-fluoro-3,3-dimethyl-2H-indol-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(5-fluorospiro[2H-indole-3,1'-cyclopropane]-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-[3-(hydroxymethyl)-2,3-dihydroindol-1-yl]-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;N-(oxan-4-yl)-7-spiro[2H-indole-3,4'-oxane]-1-yl-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide
• PubChem CID: 157256134
• Molecular Formula: C121H124F2N30O15S6
• Molecular Weight: 2468.92 g/mol
• Exact Mass: 2466.82
• IUPAC Name: 7-(2,3-dihydroindol-1-yl)-N-(2,3-dihydroxypropyl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(2,3-dihydroindol-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(5-fluoro-3,3-dimethyl-2H-indol-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(5-fluorospiro[2H-indole-3,1'-cyclopropane]-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-[3-(hydroxymethyl)-2,3-dihydroindol-1-yl]-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;N-(oxan-4-yl)-7-spiro[2H-indole-3,4'-oxane]-1-yl-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide
• SMILES: CC1(C)CN(c2ncnc3sc(C(=O)NC4CCOCC4)nc23)c2ccc(F)cc21.O=C(NC1CCOCC1)c1nc2c(N3CC(CO)c4ccccc43)ncnc2s1.O=C(NC1CCOCC1)c1nc2c(N3CC4(CC4)c4cc(F)ccc43)ncnc2s1.O=C(NC1CCOCC1)c1nc2c(N3CC4(CCOCC4)c4ccccc43)ncnc2s1.O=C(NC1CCOCC1)c1nc2c(N3CCc4ccccc43)ncnc2s1.O=C(NCC(O)CO)c1nc2c(N3CCc4ccccc43)ncnc2s1
• InChI: InChI=1S/C23H25N5O3S.C21H20FN5O2S.C21H22FN5O2S.C20H21N5O3S.C19H19N5O2S.C17H17N5O3S/c29-20(26-15-5-9-30-10-6-15)22-27-18-19(24-14-25-21(18)32-22)28-13-23(7-11-31-12-8-23)16-3-1-2-4-17(16)28;22-12-1-2-15-14(9-12)21(5-6-21)10-27(15)17-16-19(24-11-23-17)30-20(26-16)18(28)25-13-3-7-29-8-4-13;1-21(2)10-27(15-4-3-12(22)9-14(15)21)17-16-19(24-11-23-17)30-20(26-16)18(28)25-13-5-7-29-8-6-13;26-10-12-9-25(15-4-2-1-3-14(12)15)17-16-19(22-11-21-17)29-20(24-16)18(27)23-13-5-7-28-8-6-13;25-17(22-13-6-9-26-10-7-13)19-23-15-16(20-11-21-18(15)27-19)24-8-5-12-3-1-2-4-14(12)24;23-8-11(24)7-18-15(25)17-21-13-14(19-9-20-16(13)26-17)22-6-5-10-3-1-2-4-12(10)22/h1-4,14-15H,5-13H2,(H,26,29);1-2,9,11,13H,3-8,10H2,(H,25,28);3-4,9,11,13H,5-8,10H2,1-2H3,(H,25,28);1-4,11-13,26H,5-10H2,(H,23,27);1-4,11,13H,5-10H2,(H,22,25);1-4,9,11,23-24H,5-8H2,(H,18,25)
• InChIKey: AWXKIMZKFMKPDX-UHFFFAOYSA-N
• XLogP: 15.85
• TPSA: 542.13 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 45
• Rotatable Bonds: 21
• Heavy Atoms: 174
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2468.92
LogP ≤ 5	15.85
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	45

Frequently Asked Questions

What is the IUPAC name of 7-(2,3-dihydroindol-1-yl)-N-(2,3-dihydroxypropyl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(2,3-dihydroindol-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(5-fluoro-3,3-dimethyl-2H-indol-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(5-fluorospiro[2H-indole-3,1'-cyclopropane]-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-[3-(hydroxymethyl)-2,3-dihydroindol-1-yl]-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;N-(oxan-4-yl)-7-spiro[2H-indole-3,4'-oxane]-1-yl-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide?

The IUPAC name of 7-(2,3-dihydroindol-1-yl)-N-(2,3-dihydroxypropyl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(2,3-dihydroindol-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(5-fluoro-3,3-dimethyl-2H-indol-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(5-fluorospiro[2H-indole-3,1'-cyclopropane]-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-[3-(hydroxymethyl)-2,3-dihydroindol-1-yl]-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;N-(oxan-4-yl)-7-spiro[2H-indole-3,4'-oxane]-1-yl-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide (CID 157256134) is 7-(2,3-dihydroindol-1-yl)-N-(2,3-dihydroxypropyl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(2,3-dihydroindol-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(5-fluoro-3,3-dimethyl-2H-indol-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(5-fluorospiro[2H-indole-3,1'-cyclopropane]-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-[3-(hydroxymethyl)-2,3-dihydroindol-1-yl]-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;N-(oxan-4-yl)-7-spiro[2H-indole-3,4'-oxane]-1-yl-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide.

What is the SMILES notation for 7-(2,3-dihydroindol-1-yl)-N-(2,3-dihydroxypropyl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(2,3-dihydroindol-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(5-fluoro-3,3-dimethyl-2H-indol-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(5-fluorospiro[2H-indole-3,1'-cyclopropane]-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-[3-(hydroxymethyl)-2,3-dihydroindol-1-yl]-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;N-(oxan-4-yl)-7-spiro[2H-indole-3,4'-oxane]-1-yl-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide?

The canonical SMILES for 7-(2,3-dihydroindol-1-yl)-N-(2,3-dihydroxypropyl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(2,3-dihydroindol-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(5-fluoro-3,3-dimethyl-2H-indol-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(5-fluorospiro[2H-indole-3,1'-cyclopropane]-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-[3-(hydroxymethyl)-2,3-dihydroindol-1-yl]-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;N-(oxan-4-yl)-7-spiro[2H-indole-3,4'-oxane]-1-yl-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide is CC1(C)CN(c2ncnc3sc(C(=O)NC4CCOCC4)nc23)c2ccc(F)cc21.O=C(NC1CCOCC1)c1nc2c(N3CC(CO)c4ccccc43)ncnc2s1.O=C(NC1CCOCC1)c1nc2c(N3CC4(CC4)c4cc(F)ccc43)ncnc2s1.O=C(NC1CCOCC1)c1nc2c(N3CC4(CCOCC4)c4ccccc43)ncnc2s1.O=C(NC1CCOCC1)c1nc2c(N3CCc4ccccc43)ncnc2s1.O=C(NCC(O)CO)c1nc2c(N3CCc4ccccc43)ncnc2s1.

What is the InChIKey of 7-(2,3-dihydroindol-1-yl)-N-(2,3-dihydroxypropyl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(2,3-dihydroindol-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(5-fluoro-3,3-dimethyl-2H-indol-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(5-fluorospiro[2H-indole-3,1'-cyclopropane]-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-[3-(hydroxymethyl)-2,3-dihydroindol-1-yl]-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;N-(oxan-4-yl)-7-spiro[2H-indole-3,4'-oxane]-1-yl-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide?

The InChIKey is AWXKIMZKFMKPDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N5O3S.C21H20FN5O2S.C21H22FN5O2S.C20H21N5O3S.C19H19N5O2S.C17H17N5O3S/c29-20(26-15-5-9-30-10-6-15)22-27-18-19(24-14-25-21(18)32-22)28-13-23(7-11-31-12-8-23)16-3-1-2-4-17(16)28;22-12-1-2-15-14(9-12)21(5-6-21)10-27(15)17-16-19(24-11-23-17)30-20(26-16)18(28)25-13-3-7-29-8-4-13;1-21(2)10-27(15-4-3-12(22)9-14(15)21)17-16-19(24-11-23-17)30-20(26-16)18(28)25-13-5-7-29-8-6-13;26-10-12-9-25(15-4-2-1-3-14(12)15)17-16-19(22-11-21-17)29-20(24-16)18(27)23-13-5-7-28-8-6-13;25-17(22-13-6-9-26-10-7-13)19-23-15-16(20-11-21-18(15)27-19)24-8-5-12-3-1-2-4-14(12)24;23-8-11(24)7-18-15(25)17-21-13-14(19-9-20-16(13)26-17)22-6-5-10-3-1-2-4-12(10)22/h1-4,14-15H,5-13H2,(H,26,29);1-2,9,11,13H,3-8,10H2,(H,25,28);3-4,9,11,13H,5-8,10H2,1-2H3,(H,25,28);1-4,11-13,26H,5-10H2,(H,23,27);1-4,11,13H,5-10H2,(H,22,25);1-4,9,11,23-24H,5-8H2,(H,18,25).

What are the key properties of 7-(2,3-dihydroindol-1-yl)-N-(2,3-dihydroxypropyl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(2,3-dihydroindol-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(5-fluoro-3,3-dimethyl-2H-indol-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(5-fluorospiro[2H-indole-3,1'-cyclopropane]-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-[3-(hydroxymethyl)-2,3-dihydroindol-1-yl]-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;N-(oxan-4-yl)-7-spiro[2H-indole-3,4'-oxane]-1-yl-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide?

7-(2,3-dihydroindol-1-yl)-N-(2,3-dihydroxypropyl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(2,3-dihydroindol-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(5-fluoro-3,3-dimethyl-2H-indol-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(5-fluorospiro[2H-indole-3,1'-cyclopropane]-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-[3-(hydroxymethyl)-2,3-dihydroindol-1-yl]-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;N-(oxan-4-yl)-7-spiro[2H-indole-3,4'-oxane]-1-yl-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide has a molecular weight of 2468.92 g/mol, XLogP of 15.85, 21 rotatable bonds, 9 hydrogen bond donors, and 45 hydrogen bond acceptors.

Where does this data come from?

All data for 7-(2,3-dihydroindol-1-yl)-N-(2,3-dihydroxypropyl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(2,3-dihydroindol-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(5-fluoro-3,3-dimethyl-2H-indol-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-(5-fluorospiro[2H-indole-3,1'-cyclopropane]-1-yl)-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;7-[3-(hydroxymethyl)-2,3-dihydroindol-1-yl]-N-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide;N-(oxan-4-yl)-7-spiro[2H-indole-3,4'-oxane]-1-yl-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide is sourced from PubChem (CID 157256134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).