6-(4-chlorophenyl)-N-ethyl-5-(hydroxymethyl)imidazo[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

C82H81Cl5N14O11S5 — CID 161064769

IUPAC6-(4-chlorophenyl)-N-ethyl-5-(hydroxymethyl)imidazo[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
SMILESCC(C)(O)c1cn2c(CO)c(-c3ccc(Cl)cc3)nc2s1.CCCCC(=O)c1cn2c(CO)c(-c3ccc(Cl)cc3)nc2s1.CCNC(=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
InChIInChI=1S/C18H19ClN4O2S.C17H16ClN3O3S.C17H17ClN2O2S.C15H14ClN3O2S.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;1-2-17-14(21)12-7-19-11(8-20)13(18-15(19)22-12)9-3-5-10(16)6-4-9;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;3-7,20H,2,8H2,1H3,(H,17,21);3-7,19-20H,8H2,1-2H3
InChIKeyUDWHNWFWGVCKOO-UHFFFAOYSA-N
MW1776.24 g/mol
LogP16.25
Rot. Bonds19

About 6-(4-chlorophenyl)-N-ethyl-5-(hydroxymethyl)imidazo[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)imidazo[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 161064769) has the molecular formula C82H81Cl5N14O11S5 and a molecular weight of 1776.24 g/mol. Its IUPAC name is 6-(4-chlorophenyl)-N-ethyl-5-(hydroxymethyl)imidazo[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 Name6-(4-chlorophenyl)-N-ethyl-5-(hydroxymethyl)imidazo[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 CID161064769
Molecular FormulaC82H81Cl5N14O11S5
Molecular Weight1776.24 g/mol
Exact Mass1772.33
IUPAC Name6-(4-chlorophenyl)-N-ethyl-5-(hydroxymethyl)imidazo[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
SMILESCC(C)(O)c1cn2c(CO)c(-c3ccc(Cl)cc3)nc2s1.CCCCC(=O)c1cn2c(CO)c(-c3ccc(Cl)cc3)nc2s1.CCNC(=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
InChIInChI=1S/C18H19ClN4O2S.C17H16ClN3O3S.C17H17ClN2O2S.C15H14ClN3O2S.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;1-2-17-14(21)12-7-19-11(8-20)13(18-15(19)22-12)9-3-5-10(16)6-4-9;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;3-7,20H,2,8H2,1H3,(H,17,21);3-7,19-20H,8H2,1-2H3
InChIKeyUDWHNWFWGVCKOO-UHFFFAOYSA-N
XLogP16.25
TPSA307.14 Ų
H-Bond Donors7
H-Bond Acceptors27
Rotatable Bonds19
Heavy Atoms117
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001776.24
LogP ≤ 516.25
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1027

Analyze 6-(4-chlorophenyl)-N-ethyl-5-(hydroxymethyl)imidazo[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 with MolForge

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Related Compounds

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]-cyclopropylmethanol;1-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanol;[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;2-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]propan-2-ol
CID 161207585
N-ethyl-4-[[2-methyl-6-(4-methylphenyl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]piperazine-1-carboxamide
CID 42811293
(2-chlorophenyl)-[4-[[6-(4-chlorophenyl)-2-methylimidazo[2,1-b][1,3]thiazol-5-yl]methyl]piperazin-1-yl]methanone
CID 83285872
1-[2-(4-chlorophenyl)-3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-6-yl]butan-1-one
CID 157343544
1-[[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]-N-ethylpiperidine-4-carboxamide
CID 86931065
[6-(ethylamino)-2-pyridinyl]-morpholin-4-ylmethanone
CID 62239087
[5-(4-chlorophenyl)-1,2-oxazol-3-yl]-morpholin-4-ylmethanone;ethane
CID 144928448
[6-(4-tert-butylphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanol
CID 82367673
[5-(4-chlorophenyl)-1,2-oxazol-3-yl]-(4-methylpiperazin-1-yl)methanone
CID 15997087
5-(4-chlorophenyl)-N-[2-(ethylamino)-2-oxoethyl]thiophene-2-carboxamide
CID 18145657
2-[2-amino-4-(4-chlorophenyl)-1,3-thiazol-5-yl]-1-morpholin-4-ylethanone
CID 12559825
N-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide
CID 60597314

Frequently Asked Questions

What is the IUPAC name of 6-(4-chlorophenyl)-N-ethyl-5-(hydroxymethyl)imidazo[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)imidazo[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 161064769) is 6-(4-chlorophenyl)-N-ethyl-5-(hydroxymethyl)imidazo[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)imidazo[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)imidazo[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.CCNC(=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)imidazo[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 UDWHNWFWGVCKOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19ClN4O2S.C17H16ClN3O3S.C17H17ClN2O2S.C15H14ClN3O2S.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;1-2-17-14(21)12-7-19-11(8-20)13(18-15(19)22-12)9-3-5-10(16)6-4-9;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;3-7,20H,2,8H2,1H3,(H,17,21);3-7,19-20H,8H2,1-2H3.
What are the key properties of 6-(4-chlorophenyl)-N-ethyl-5-(hydroxymethyl)imidazo[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)imidazo[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 1776.24 g/mol, XLogP of 16.25, 19 rotatable bonds, 7 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-chlorophenyl)-N-ethyl-5-(hydroxymethyl)imidazo[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 161064769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).