N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-4-sulfamoylbenzamide

C19H16N4O3S2 — CID 7488144

IUPACN-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-4-sulfamoylbenzamide
SMILESCc1csc2nc(-c3ccc(NC(=O)c4ccc(S(N)(=O)=O)cc4)cc3)cn12
InChIInChI=1S/C19H16N4O3S2/c1-12-11-27-19-22-17(10-23(12)19)13-2-6-15(7-3-13)21-18(24)14-4-8-16(9-5-14)28(20,25)26/h2-11H,1H3,(H,21,24)(H2,20,25,26)
InChIKeyUYLMHAHPQCNRCG-UHFFFAOYSA-N
MW412.50 g/mol
LogP3.27
Rot. Bonds4

About N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-4-sulfamoylbenzamide

N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-4-sulfamoylbenzamide (PubChem CID 7488144) has the molecular formula C19H16N4O3S2 and a molecular weight of 412.50 g/mol. Its IUPAC name is N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-4-sulfamoylbenzamide.

Molecular Properties

Compound NameN-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-4-sulfamoylbenzamide
PubChem CID7488144
Molecular FormulaC19H16N4O3S2
Molecular Weight412.50 g/mol
Exact Mass412.07
IUPAC NameN-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-4-sulfamoylbenzamide
SMILESCc1csc2nc(-c3ccc(NC(=O)c4ccc(S(N)(=O)=O)cc4)cc3)cn12
InChIInChI=1S/C19H16N4O3S2/c1-12-11-27-19-22-17(10-23(12)19)13-2-6-15(7-3-13)21-18(24)14-4-8-16(9-5-14)28(20,25)26/h2-11H,1H3,(H,21,24)(H2,20,25,26)
InChIKeyUYLMHAHPQCNRCG-UHFFFAOYSA-N
XLogP3.27
TPSA106.56 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.50
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-chloro-N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]benzamide
CID 40506385
4-tert-butyl-N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]benzamide
CID 40691828
3,4-dimethyl-N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]benzamide
CID 40506377
2-benzoyl-N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]benzamide
CID 41427247
N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]benzamide
CID 43936475
2-ethyl-N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]butanamide
CID 18562197
N-(4-sulfamoylphenyl)-6-thiophen-2-ylimidazo[2,1-b][1,3]thiazole-3-carboxamide
CID 42270174
2,3-dimethoxy-N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]benzamide
CID 40506337
ethyl 4-[[6-(4-methylphenyl)imidazo[2,1-b][1,3]thiazole-3-carbonyl]amino]benzoate
CID 42271723
6-[4-[(4-methoxybenzoyl)amino]phenyl]-N,N-dimethylimidazo[2,1-b][1,3]thiazole-3-carboxamide
CID 46396472
4-acetamido-N-(4-sulfamoylphenyl)benzamide
CID 766030
N-(4-chlorophenyl)-6-(4-methylphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide
CID 42271771

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-4-sulfamoylbenzamide?
The IUPAC name of N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-4-sulfamoylbenzamide (CID 7488144) is N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-4-sulfamoylbenzamide.
What is the SMILES notation for N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-4-sulfamoylbenzamide?
The canonical SMILES for N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-4-sulfamoylbenzamide is Cc1csc2nc(-c3ccc(NC(=O)c4ccc(S(N)(=O)=O)cc4)cc3)cn12.
What is the InChIKey of N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-4-sulfamoylbenzamide?
The InChIKey is UYLMHAHPQCNRCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4O3S2/c1-12-11-27-19-22-17(10-23(12)19)13-2-6-15(7-3-13)21-18(24)14-4-8-16(9-5-14)28(20,25)26/h2-11H,1H3,(H,21,24)(H2,20,25,26).
What are the key properties of N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-4-sulfamoylbenzamide?
N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-4-sulfamoylbenzamide has a molecular weight of 412.50 g/mol, XLogP of 3.27, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-4-sulfamoylbenzamide is sourced from PubChem (CID 7488144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).