6-chloro-N-[2-chloro-5-[(2-methoxyphenyl)sulfamoyl]phenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide

C19H14Cl2N4O4S2 — CID 4069364

IUPAC6-chloro-N-[2-chloro-5-[(2-methoxyphenyl)sulfamoyl]phenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide
SMILESCOc1ccccc1NS(=O)(=O)c1ccc(Cl)c(NC(=O)c2c(Cl)nc3sccn23)c1
InChIInChI=1S/C19H14Cl2N4O4S2/c1-29-15-5-3-2-4-13(15)24-31(27,28)11-6-7-12(20)14(10-11)22-18(26)16-17(21)23-19-25(16)8-9-30-19/h2-10,24H,1H3,(H,22,26)
InChIKeyHKFQLAIDIXBZRJ-UHFFFAOYSA-N
MW497.39 g/mol
LogP4.76
Rot. Bonds6

About 6-chloro-N-[2-chloro-5-[(2-methoxyphenyl)sulfamoyl]phenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide

6-chloro-N-[2-chloro-5-[(2-methoxyphenyl)sulfamoyl]phenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide (PubChem CID 4069364) has the molecular formula C19H14Cl2N4O4S2 and a molecular weight of 497.39 g/mol. Its IUPAC name is 6-chloro-N-[2-chloro-5-[(2-methoxyphenyl)sulfamoyl]phenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide.

Molecular Properties

Compound Name6-chloro-N-[2-chloro-5-[(2-methoxyphenyl)sulfamoyl]phenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide
PubChem CID4069364
Molecular FormulaC19H14Cl2N4O4S2
Molecular Weight497.39 g/mol
Exact Mass495.98
IUPAC Name6-chloro-N-[2-chloro-5-[(2-methoxyphenyl)sulfamoyl]phenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide
SMILESCOc1ccccc1NS(=O)(=O)c1ccc(Cl)c(NC(=O)c2c(Cl)nc3sccn23)c1
InChIInChI=1S/C19H14Cl2N4O4S2/c1-29-15-5-3-2-4-13(15)24-31(27,28)11-6-7-12(20)14(10-11)22-18(26)16-17(21)23-19-25(16)8-9-30-19/h2-10,24H,1H3,(H,22,26)
InChIKeyHKFQLAIDIXBZRJ-UHFFFAOYSA-N
XLogP4.76
TPSA101.80 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500497.39
LogP ≤ 54.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

6-chloro-N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxyphenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide
CID 16605008
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CID 6105148
2-chloro-N-[2-fluoro-4-[(2-methoxyphenyl)sulfamoyl]phenyl]benzamide
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CID 4836454
4-chloro-N-[2-hydroxy-5-[(2-methoxyphenyl)sulfamoyl]phenyl]-3-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 4097318
N-[2-chloro-5-[(2-methoxyphenyl)sulfamoyl]phenyl]-3-nitro-4-pyrrolidin-1-ylbenzamide
CID 3602525
3-chloro-4-methoxy-N-(2-methoxyphenyl)benzenesulfonamide
CID 961849
2-chloro-5-[(4-fluorophenyl)sulfamoyl]-N-[4-[(2-methoxyphenyl)sulfamoyl]phenyl]benzamide
CID 2332788
N-[5-[[2-(2-chlorophenoxy)phenyl]sulfamoyl]-2-methoxyphenyl]acetamide
CID 24514729
N-[2-methoxy-5-[(2-methoxyphenyl)sulfamoyl]phenyl]naphthalene-2-carboxamide
CID 24635874
N-[2-methoxy-5-[(2-methoxyphenyl)sulfamoyl]phenyl]-5-methylpyrazine-2-carboxamide
CID 18292276
6-chloro-N-(2-hydroxyphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 103739497

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-[2-chloro-5-[(2-methoxyphenyl)sulfamoyl]phenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide?
The IUPAC name of 6-chloro-N-[2-chloro-5-[(2-methoxyphenyl)sulfamoyl]phenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide (CID 4069364) is 6-chloro-N-[2-chloro-5-[(2-methoxyphenyl)sulfamoyl]phenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide.
What is the SMILES notation for 6-chloro-N-[2-chloro-5-[(2-methoxyphenyl)sulfamoyl]phenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide?
The canonical SMILES for 6-chloro-N-[2-chloro-5-[(2-methoxyphenyl)sulfamoyl]phenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide is COc1ccccc1NS(=O)(=O)c1ccc(Cl)c(NC(=O)c2c(Cl)nc3sccn23)c1.
What is the InChIKey of 6-chloro-N-[2-chloro-5-[(2-methoxyphenyl)sulfamoyl]phenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide?
The InChIKey is HKFQLAIDIXBZRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14Cl2N4O4S2/c1-29-15-5-3-2-4-13(15)24-31(27,28)11-6-7-12(20)14(10-11)22-18(26)16-17(21)23-19-25(16)8-9-30-19/h2-10,24H,1H3,(H,22,26).
What are the key properties of 6-chloro-N-[2-chloro-5-[(2-methoxyphenyl)sulfamoyl]phenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide?
6-chloro-N-[2-chloro-5-[(2-methoxyphenyl)sulfamoyl]phenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide has a molecular weight of 497.39 g/mol, XLogP of 4.76, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-[2-chloro-5-[(2-methoxyphenyl)sulfamoyl]phenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide is sourced from PubChem (CID 4069364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).