2-(4-bromophenyl)-5-(5-methylthiophen-2-yl)-1,3-thiazole

C14H10BrNS2 — CID 14424310

IUPAC2-(4-bromophenyl)-5-(5-methylthiophen-2-yl)-1,3-thiazole
SMILESCc1ccc(-c2cnc(-c3ccc(Br)cc3)s2)s1
InChIInChI=1S/C14H10BrNS2/c1-9-2-7-12(17-9)13-8-16-14(18-13)10-3-5-11(15)6-4-10/h2-8H,1H3
InChIKeyLEYUWPVOFYSDDU-UHFFFAOYSA-N
MW336.28 g/mol
LogP5.61
Rot. Bonds2

About 2-(4-bromophenyl)-5-(5-methylthiophen-2-yl)-1,3-thiazole

2-(4-bromophenyl)-5-(5-methylthiophen-2-yl)-1,3-thiazole (PubChem CID 14424310) has the molecular formula C14H10BrNS2 and a molecular weight of 336.28 g/mol. Its IUPAC name is 2-(4-bromophenyl)-5-(5-methylthiophen-2-yl)-1,3-thiazole.

Molecular Properties

Compound Name2-(4-bromophenyl)-5-(5-methylthiophen-2-yl)-1,3-thiazole
PubChem CID14424310
Molecular FormulaC14H10BrNS2
Molecular Weight336.28 g/mol
Exact Mass334.94
IUPAC Name2-(4-bromophenyl)-5-(5-methylthiophen-2-yl)-1,3-thiazole
SMILESCc1ccc(-c2cnc(-c3ccc(Br)cc3)s2)s1
InChIInChI=1S/C14H10BrNS2/c1-9-2-7-12(17-9)13-8-16-14(18-13)10-3-5-11(15)6-4-10/h2-8H,1H3
InChIKeyLEYUWPVOFYSDDU-UHFFFAOYSA-N
XLogP5.61
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.28
LogP ≤ 55.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(4-bromophenyl)-1,3-thiazol-5-yl]ethanol
CID 62652128
1-[2-(4-bromophenyl)-1,3-thiazol-5-yl]propan-2-amine
CID 115091945
ethane;2-methyl-5-(5-methylthiophen-2-yl)thiophene
CID 91463281
bis[2-(4-bromophenyl)-1,3-thiazol-5-yl]methanone
CID 150749355
2-(4-bromophenyl)-5-(4-methylphenyl)thiophene
CID 174894366
ethane;5-methyl-2-(4-methylphenyl)-1,3-thiazole
CID 123316346
2-(4-bromophenyl)-1,3-thiazole-5-sulfonamide
CID 167727665
2,5-bis[5-(5-methylthiophen-2-yl)thiophen-2-yl]pyrazine
CID 22960139
2-bromo-5-(5-methylthiophen-2-yl)-1,3-oxazole
CID 117259565
5-(4-bromophenyl)-2-propan-2-yl-1,3-thiazole
CID 58910461
[5-(5-methylthiophen-2-yl)-1,3-thiazol-2-yl]methanamine
CID 130541584
2,4-bis(4-bromophenyl)-5-methyl-1,3-thiazole
CID 78907473

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)-5-(5-methylthiophen-2-yl)-1,3-thiazole?
The IUPAC name of 2-(4-bromophenyl)-5-(5-methylthiophen-2-yl)-1,3-thiazole (CID 14424310) is 2-(4-bromophenyl)-5-(5-methylthiophen-2-yl)-1,3-thiazole.
What is the SMILES notation for 2-(4-bromophenyl)-5-(5-methylthiophen-2-yl)-1,3-thiazole?
The canonical SMILES for 2-(4-bromophenyl)-5-(5-methylthiophen-2-yl)-1,3-thiazole is Cc1ccc(-c2cnc(-c3ccc(Br)cc3)s2)s1.
What is the InChIKey of 2-(4-bromophenyl)-5-(5-methylthiophen-2-yl)-1,3-thiazole?
The InChIKey is LEYUWPVOFYSDDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrNS2/c1-9-2-7-12(17-9)13-8-16-14(18-13)10-3-5-11(15)6-4-10/h2-8H,1H3.
What are the key properties of 2-(4-bromophenyl)-5-(5-methylthiophen-2-yl)-1,3-thiazole?
2-(4-bromophenyl)-5-(5-methylthiophen-2-yl)-1,3-thiazole has a molecular weight of 336.28 g/mol, XLogP of 5.61, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)-5-(5-methylthiophen-2-yl)-1,3-thiazole is sourced from PubChem (CID 14424310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).