8-[7-amino-8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]imidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;[8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-5-(4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl)imidazo[1,2-c]pyrimidin-7-yl]methanol;8-[8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;8-[7-amino-8-(2,3-dichlorophenyl)sulfanyl-3-methylimidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;[5-(4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl)-8-(2,3-dichlorophenyl)sulfanyl-7-methylimidazo[1,2-c]pyrimidin-3-yl]methanol

C107H130Cl7N33O7S5 — CID 165078522

About 8-[7-amino-8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]imidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;[8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-5-(4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl)imidazo[1,2-c]pyrimidin-7-yl]methanol;8-[8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;8-[7-amino-8-(2,3-dichlorophenyl)sulfanyl-3-methylimidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;[5-(4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl)-8-(2,3-dichlorophenyl)sulfanyl-7-methylimidazo[1,2-c]pyrimidin-3-yl]methanol

8-[7-amino-8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]imidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;[8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-5-(4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl)imidazo[1,2-c]pyrimidin-7-yl]methanol;8-[8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;8-[7-amino-8-(2,3-dichlorophenyl)sulfanyl-3-methylimidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;[5-(4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl)-8-(2,3-dichlorophenyl)sulfanyl-7-methylimidazo[1,2-c]pyrimidin-3-yl]methanol (PubChem CID 165078522) has the molecular formula C107H130Cl7N33O7S5 and a molecular weight of 2398.95 g/mol. Its IUPAC name is 8-[7-amino-8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]imidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;[8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-5-(4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl)imidazo[1,2-c]pyrimidin-7-yl]methanol;8-[8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;8-[7-amino-8-(2,3-dichlorophenyl)sulfanyl-3-methylimidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;[5-(4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl)-8-(2,3-dichlorophenyl)sulfanyl-7-methylimidazo[1,2-c]pyrimidin-3-yl]methanol.

Molecular Properties

• Compound Name: 8-[7-amino-8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]imidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;[8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-5-(4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl)imidazo[1,2-c]pyrimidin-7-yl]methanol;8-[8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;8-[7-amino-8-(2,3-dichlorophenyl)sulfanyl-3-methylimidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;[5-(4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl)-8-(2,3-dichlorophenyl)sulfanyl-7-methylimidazo[1,2-c]pyrimidin-3-yl]methanol
• PubChem CID: 165078522
• Molecular Formula: C107H130Cl7N33O7S5
• Molecular Weight: 2398.95 g/mol
• Exact Mass: 2393.73
• IUPAC Name: 8-[7-amino-8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]imidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;[8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-5-(4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl)imidazo[1,2-c]pyrimidin-7-yl]methanol;8-[8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;8-[7-amino-8-(2,3-dichlorophenyl)sulfanyl-3-methylimidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;[5-(4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl)-8-(2,3-dichlorophenyl)sulfanyl-7-methylimidazo[1,2-c]pyrimidin-3-yl]methanol
• SMILES: CC1OCC2(CCN(c3nc(CO)c(Sc4ccnc(N)c4Cl)c4nccn34)CC2)C1N.CC1OCC2(CCN(c3nc(N)c(Sc4ccnc(N)c4Cl)c4nccn34)CC2)C1N.Cc1cnc2c(Sc3cccc(Cl)c3Cl)c(N)nc(N3CCC4(CC3)COC(C)C4N)n12.Cc1nc(N2CCC3(CC2)COC(C)C3N)n2c(CO)cnc2c1Sc1cccc(Cl)c1Cl.Cc1nc(N2CCC3(CC2)COC(C)C3N)n2ccnc2c1Sc1ccnc(N)c1Cl
• InChI: InChI=1S/C23H27Cl2N5O2S.C22H26Cl2N6OS.C21H26ClN7O2S.C21H26ClN7OS.C20H25ClN8OS/c1-13-19(33-17-5-3-4-16(24)18(17)25)21-27-10-15(11-31)30(21)22(28-13)29-8-6-23(7-9-29)12-32-14(2)20(23)26;1-12-10-27-20-17(32-15-5-3-4-14(23)16(15)24)19(26)28-21(30(12)20)29-8-6-22(7-9-29)11-31-13(2)18(22)25;1-12-17(23)21(11-31-12)3-7-28(8-4-21)20-27-13(10-30)16(19-26-6-9-29(19)20)32-14-2-5-25-18(24)15(14)22;1-12-16(31-14-3-6-25-18(24)15(14)22)19-26-7-10-29(19)20(27-12)28-8-4-21(5-9-28)11-30-13(2)17(21)23;1-11-15(22)20(10-30-11)3-7-28(8-4-20)19-27-17(24)14(18-26-6-9-29(18)19)31-12-2-5-25-16(23)13(12)21/h3-5,10,14,20,31H,6-9,11-12,26H2,1-2H3;3-5,10,13,18H,6-9,11,25-26H2,1-2H3;2,5-6,9,12,17,30H,3-4,7-8,10-11,23H2,1H3,(H2,24,25);3,6-7,10,13,17H,4-5,8-9,11,23H2,1-2H3,(H2,24,25);2,5-6,9,11,15H,3-4,7-8,10,22,24H2,1H3,(H2,23,25)
• InChIKey: USOCASPDNPPLKX-UHFFFAOYSA-N
• XLogP: 16.65
• TPSA: 552.63 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 45
• Rotatable Bonds: 17
• Heavy Atoms: 159
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2398.95
LogP ≤ 5	16.65
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	45

Frequently Asked Questions

What is the IUPAC name of 8-[7-amino-8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]imidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;[8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-5-(4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl)imidazo[1,2-c]pyrimidin-7-yl]methanol;8-[8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;8-[7-amino-8-(2,3-dichlorophenyl)sulfanyl-3-methylimidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;[5-(4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl)-8-(2,3-dichlorophenyl)sulfanyl-7-methylimidazo[1,2-c]pyrimidin-3-yl]methanol?

The IUPAC name of 8-[7-amino-8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]imidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;[8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-5-(4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl)imidazo[1,2-c]pyrimidin-7-yl]methanol;8-[8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;8-[7-amino-8-(2,3-dichlorophenyl)sulfanyl-3-methylimidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;[5-(4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl)-8-(2,3-dichlorophenyl)sulfanyl-7-methylimidazo[1,2-c]pyrimidin-3-yl]methanol (CID 165078522) is 8-[7-amino-8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]imidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;[8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-5-(4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl)imidazo[1,2-c]pyrimidin-7-yl]methanol;8-[8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;8-[7-amino-8-(2,3-dichlorophenyl)sulfanyl-3-methylimidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;[5-(4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl)-8-(2,3-dichlorophenyl)sulfanyl-7-methylimidazo[1,2-c]pyrimidin-3-yl]methanol.

What is the SMILES notation for 8-[7-amino-8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]imidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;[8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-5-(4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl)imidazo[1,2-c]pyrimidin-7-yl]methanol;8-[8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;8-[7-amino-8-(2,3-dichlorophenyl)sulfanyl-3-methylimidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;[5-(4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl)-8-(2,3-dichlorophenyl)sulfanyl-7-methylimidazo[1,2-c]pyrimidin-3-yl]methanol?

The canonical SMILES for 8-[7-amino-8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]imidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;[8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-5-(4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl)imidazo[1,2-c]pyrimidin-7-yl]methanol;8-[8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;8-[7-amino-8-(2,3-dichlorophenyl)sulfanyl-3-methylimidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;[5-(4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl)-8-(2,3-dichlorophenyl)sulfanyl-7-methylimidazo[1,2-c]pyrimidin-3-yl]methanol is CC1OCC2(CCN(c3nc(CO)c(Sc4ccnc(N)c4Cl)c4nccn34)CC2)C1N.CC1OCC2(CCN(c3nc(N)c(Sc4ccnc(N)c4Cl)c4nccn34)CC2)C1N.Cc1cnc2c(Sc3cccc(Cl)c3Cl)c(N)nc(N3CCC4(CC3)COC(C)C4N)n12.Cc1nc(N2CCC3(CC2)COC(C)C3N)n2c(CO)cnc2c1Sc1cccc(Cl)c1Cl.Cc1nc(N2CCC3(CC2)COC(C)C3N)n2ccnc2c1Sc1ccnc(N)c1Cl.

What is the InChIKey of 8-[7-amino-8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]imidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;[8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-5-(4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl)imidazo[1,2-c]pyrimidin-7-yl]methanol;8-[8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;8-[7-amino-8-(2,3-dichlorophenyl)sulfanyl-3-methylimidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;[5-(4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl)-8-(2,3-dichlorophenyl)sulfanyl-7-methylimidazo[1,2-c]pyrimidin-3-yl]methanol?

The InChIKey is USOCASPDNPPLKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27Cl2N5O2S.C22H26Cl2N6OS.C21H26ClN7O2S.C21H26ClN7OS.C20H25ClN8OS/c1-13-19(33-17-5-3-4-16(24)18(17)25)21-27-10-15(11-31)30(21)22(28-13)29-8-6-23(7-9-29)12-32-14(2)20(23)26;1-12-10-27-20-17(32-15-5-3-4-14(23)16(15)24)19(26)28-21(30(12)20)29-8-6-22(7-9-29)11-31-13(2)18(22)25;1-12-17(23)21(11-31-12)3-7-28(8-4-21)20-27-13(10-30)16(19-26-6-9-29(19)20)32-14-2-5-25-18(24)15(14)22;1-12-16(31-14-3-6-25-18(24)15(14)22)19-26-7-10-29(19)20(27-12)28-8-4-21(5-9-28)11-30-13(2)17(21)23;1-11-15(22)20(10-30-11)3-7-28(8-4-20)19-27-17(24)14(18-26-6-9-29(18)19)31-12-2-5-25-16(23)13(12)21/h3-5,10,14,20,31H,6-9,11-12,26H2,1-2H3;3-5,10,13,18H,6-9,11,25-26H2,1-2H3;2,5-6,9,12,17,30H,3-4,7-8,10-11,23H2,1H3,(H2,24,25);3,6-7,10,13,17H,4-5,8-9,11,23H2,1-2H3,(H2,24,25);2,5-6,9,11,15H,3-4,7-8,10,22,24H2,1H3,(H2,23,25).

What are the key properties of 8-[7-amino-8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]imidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;[8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-5-(4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl)imidazo[1,2-c]pyrimidin-7-yl]methanol;8-[8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;8-[7-amino-8-(2,3-dichlorophenyl)sulfanyl-3-methylimidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;[5-(4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl)-8-(2,3-dichlorophenyl)sulfanyl-7-methylimidazo[1,2-c]pyrimidin-3-yl]methanol?

8-[7-amino-8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]imidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;[8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-5-(4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl)imidazo[1,2-c]pyrimidin-7-yl]methanol;8-[8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;8-[7-amino-8-(2,3-dichlorophenyl)sulfanyl-3-methylimidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;[5-(4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl)-8-(2,3-dichlorophenyl)sulfanyl-7-methylimidazo[1,2-c]pyrimidin-3-yl]methanol has a molecular weight of 2398.95 g/mol, XLogP of 16.65, 17 rotatable bonds, 12 hydrogen bond donors, and 45 hydrogen bond acceptors.

Where does this data come from?

All data for 8-[7-amino-8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]imidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;[8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-5-(4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl)imidazo[1,2-c]pyrimidin-7-yl]methanol;8-[8-[(2-amino-3-chloro-4-pyridinyl)sulfanyl]-7-methylimidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;8-[7-amino-8-(2,3-dichlorophenyl)sulfanyl-3-methylimidazo[1,2-c]pyrimidin-5-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;[5-(4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl)-8-(2,3-dichlorophenyl)sulfanyl-7-methylimidazo[1,2-c]pyrimidin-3-yl]methanol is sourced from PubChem (CID 165078522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).