6-(4-chlorophenyl)-N-ethyl-5-(hydroxymethyl)-N-methylimidazo[2,1-b][1,3]thiazole-2-carboxamide;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-(4-methylpiperazin-1-yl)methanone;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone;1-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]pentan-1-one;2-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]propan-2-ol

C83H83Cl5N14O11S5 — CID 159702928

About 6-(4-chlorophenyl)-N-ethyl-5-(hydroxymethyl)-N-methylimidazo[2,1-b][1,3]thiazole-2-carboxamide;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-(4-methylpiperazin-1-yl)methanone;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone;1-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]pentan-1-one;2-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]propan-2-ol

6-(4-chlorophenyl)-N-ethyl-5-(hydroxymethyl)-N-methylimidazo[2,1-b][1,3]thiazole-2-carboxamide;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-(4-methylpiperazin-1-yl)methanone;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone;1-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]pentan-1-one;2-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]propan-2-ol (PubChem CID 159702928) has the molecular formula C83H83Cl5N14O11S5 and a molecular weight of 1790.26 g/mol. Its IUPAC name is 6-(4-chlorophenyl)-N-ethyl-5-(hydroxymethyl)-N-methylimidazo[2,1-b][1,3]thiazole-2-carboxamide;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-(4-methylpiperazin-1-yl)methanone;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone;1-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]pentan-1-one;2-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]propan-2-ol.

Molecular Properties

• Compound Name: 6-(4-chlorophenyl)-N-ethyl-5-(hydroxymethyl)-N-methylimidazo[2,1-b][1,3]thiazole-2-carboxamide;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-(4-methylpiperazin-1-yl)methanone;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone;1-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]pentan-1-one;2-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]propan-2-ol
• PubChem CID: 159702928
• Molecular Formula: C83H83Cl5N14O11S5
• Molecular Weight: 1790.26 g/mol
• Exact Mass: 1786.34
• IUPAC Name: 6-(4-chlorophenyl)-N-ethyl-5-(hydroxymethyl)-N-methylimidazo[2,1-b][1,3]thiazole-2-carboxamide;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-(4-methylpiperazin-1-yl)methanone;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone;1-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]pentan-1-one;2-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]propan-2-ol
• SMILES: CC(C)(O)c1cn2c(CO)c(-c3ccc(Cl)cc3)nc2s1.CCCCC(=O)c1cn2c(CO)c(-c3ccc(Cl)cc3)nc2s1.CCN(C)C(=O)c1cn2c(CO)c(-c3ccc(Cl)cc3)nc2s1.CN1CCN(C(=O)c2cn3c(CO)c(-c4ccc(Cl)cc4)nc3s2)CC1.O=C(c1cn2c(CO)c(-c3ccc(Cl)cc3)nc2s1)N1CCOCC1
• InChI: InChI=1S/C18H19ClN4O2S.C17H16ClN3O3S.C17H17ClN2O2S.C16H16ClN3O2S.C15H15ClN2O2S/c1-21-6-8-22(9-7-21)17(25)15-10-23-14(11-24)16(20-18(23)26-15)12-2-4-13(19)5-3-12;18-12-3-1-11(2-4-12)15-13(10-22)21-9-14(25-17(21)19-15)16(23)20-5-7-24-8-6-20;1-2-3-4-14(22)15-9-20-13(10-21)16(19-17(20)23-15)11-5-7-12(18)8-6-11;1-3-19(2)15(22)13-8-20-12(9-21)14(18-16(20)23-13)10-4-6-11(17)7-5-10;1-15(2,20)12-7-18-11(8-19)13(17-14(18)21-12)9-3-5-10(16)6-4-9/h2-5,10,24H,6-9,11H2,1H3;1-4,9,22H,5-8,10H2;5-9,21H,2-4,10H2,1H3;4-8,21H,3,9H2,1-2H3;3-7,19-20H,8H2,1-2H3
• InChIKey: MXVWFXOXRCGCBV-UHFFFAOYSA-N
• XLogP: 16.59
• TPSA: 298.35 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 27
• Rotatable Bonds: 19
• Heavy Atoms: 118
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1790.26
LogP ≤ 5	16.59
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	27

Frequently Asked Questions

What is the IUPAC name of 6-(4-chlorophenyl)-N-ethyl-5-(hydroxymethyl)-N-methylimidazo[2,1-b][1,3]thiazole-2-carboxamide;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-(4-methylpiperazin-1-yl)methanone;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone;1-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]pentan-1-one;2-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]propan-2-ol?

The IUPAC name of 6-(4-chlorophenyl)-N-ethyl-5-(hydroxymethyl)-N-methylimidazo[2,1-b][1,3]thiazole-2-carboxamide;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-(4-methylpiperazin-1-yl)methanone;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone;1-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]pentan-1-one;2-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]propan-2-ol (CID 159702928) is 6-(4-chlorophenyl)-N-ethyl-5-(hydroxymethyl)-N-methylimidazo[2,1-b][1,3]thiazole-2-carboxamide;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-(4-methylpiperazin-1-yl)methanone;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone;1-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]pentan-1-one;2-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]propan-2-ol.

What is the SMILES notation for 6-(4-chlorophenyl)-N-ethyl-5-(hydroxymethyl)-N-methylimidazo[2,1-b][1,3]thiazole-2-carboxamide;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-(4-methylpiperazin-1-yl)methanone;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone;1-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]pentan-1-one;2-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]propan-2-ol?

The canonical SMILES for 6-(4-chlorophenyl)-N-ethyl-5-(hydroxymethyl)-N-methylimidazo[2,1-b][1,3]thiazole-2-carboxamide;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-(4-methylpiperazin-1-yl)methanone;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone;1-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]pentan-1-one;2-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]propan-2-ol is CC(C)(O)c1cn2c(CO)c(-c3ccc(Cl)cc3)nc2s1.CCCCC(=O)c1cn2c(CO)c(-c3ccc(Cl)cc3)nc2s1.CCN(C)C(=O)c1cn2c(CO)c(-c3ccc(Cl)cc3)nc2s1.CN1CCN(C(=O)c2cn3c(CO)c(-c4ccc(Cl)cc4)nc3s2)CC1.O=C(c1cn2c(CO)c(-c3ccc(Cl)cc3)nc2s1)N1CCOCC1.

What is the InChIKey of 6-(4-chlorophenyl)-N-ethyl-5-(hydroxymethyl)-N-methylimidazo[2,1-b][1,3]thiazole-2-carboxamide;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-(4-methylpiperazin-1-yl)methanone;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone;1-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]pentan-1-one;2-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]propan-2-ol?

The InChIKey is MXVWFXOXRCGCBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19ClN4O2S.C17H16ClN3O3S.C17H17ClN2O2S.C16H16ClN3O2S.C15H15ClN2O2S/c1-21-6-8-22(9-7-21)17(25)15-10-23-14(11-24)16(20-18(23)26-15)12-2-4-13(19)5-3-12;18-12-3-1-11(2-4-12)15-13(10-22)21-9-14(25-17(21)19-15)16(23)20-5-7-24-8-6-20;1-2-3-4-14(22)15-9-20-13(10-21)16(19-17(20)23-15)11-5-7-12(18)8-6-11;1-3-19(2)15(22)13-8-20-12(9-21)14(18-16(20)23-13)10-4-6-11(17)7-5-10;1-15(2,20)12-7-18-11(8-19)13(17-14(18)21-12)9-3-5-10(16)6-4-9/h2-5,10,24H,6-9,11H2,1H3;1-4,9,22H,5-8,10H2;5-9,21H,2-4,10H2,1H3;4-8,21H,3,9H2,1-2H3;3-7,19-20H,8H2,1-2H3.

What are the key properties of 6-(4-chlorophenyl)-N-ethyl-5-(hydroxymethyl)-N-methylimidazo[2,1-b][1,3]thiazole-2-carboxamide;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-(4-methylpiperazin-1-yl)methanone;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone;1-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]pentan-1-one;2-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]propan-2-ol?

6-(4-chlorophenyl)-N-ethyl-5-(hydroxymethyl)-N-methylimidazo[2,1-b][1,3]thiazole-2-carboxamide;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-(4-methylpiperazin-1-yl)methanone;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone;1-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]pentan-1-one;2-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]propan-2-ol has a molecular weight of 1790.26 g/mol, XLogP of 16.59, 19 rotatable bonds, 6 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for 6-(4-chlorophenyl)-N-ethyl-5-(hydroxymethyl)-N-methylimidazo[2,1-b][1,3]thiazole-2-carboxamide;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-(4-methylpiperazin-1-yl)methanone;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone;1-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]pentan-1-one;2-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]propan-2-ol is sourced from PubChem (CID 159702928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).