1-(4,5-dihydro-1,3-thiazol-2-yl)-3-(5-methyl-1,2-oxazol-3-yl)urea

C8H10N4O2S — CID 108812164

IUPAC1-(4,5-dihydro-1,3-thiazol-2-yl)-3-(5-methyl-1,2-oxazol-3-yl)urea
SMILESCc1cc(NC(=O)NC2=NCCS2)no1
InChIInChI=1S/C8H10N4O2S/c1-5-4-6(12-14-5)10-7(13)11-8-9-2-3-15-8/h4H,2-3H2,1H3,(H2,9,10,11,12,13)
InChIKeyUJEABYCKCBYVAN-UHFFFAOYSA-N
MW226.26 g/mol
LogP1.21
Rot. Bonds1

About 1-(4,5-dihydro-1,3-thiazol-2-yl)-3-(5-methyl-1,2-oxazol-3-yl)urea

1-(4,5-dihydro-1,3-thiazol-2-yl)-3-(5-methyl-1,2-oxazol-3-yl)urea (PubChem CID 108812164) has the molecular formula C8H10N4O2S and a molecular weight of 226.26 g/mol. Its IUPAC name is 1-(4,5-dihydro-1,3-thiazol-2-yl)-3-(5-methyl-1,2-oxazol-3-yl)urea.

Molecular Properties

Compound Name1-(4,5-dihydro-1,3-thiazol-2-yl)-3-(5-methyl-1,2-oxazol-3-yl)urea
PubChem CID108812164
Molecular FormulaC8H10N4O2S
Molecular Weight226.26 g/mol
Exact Mass226.05
IUPAC Name1-(4,5-dihydro-1,3-thiazol-2-yl)-3-(5-methyl-1,2-oxazol-3-yl)urea
SMILESCc1cc(NC(=O)NC2=NCCS2)no1
InChIInChI=1S/C8H10N4O2S/c1-5-4-6(12-14-5)10-7(13)11-8-9-2-3-15-8/h4H,2-3H2,1H3,(H2,9,10,11,12,13)
InChIKeyUJEABYCKCBYVAN-UHFFFAOYSA-N
XLogP1.21
TPSA79.52 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.26
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 845171
1-(3,5-dihydroxyphenyl)-3-(5-methyl-1,2-oxazol-3-yl)urea
CID 108895478
1-(3,5-dichlorophenyl)-3-(5-methyl-1,2-oxazol-3-yl)urea
CID 6467048
1-(5-methyl-1,2-oxazol-3-yl)-3-(4-methyl-1,3-thiazol-2-yl)urea
CID 47434402
2-methyl-2-(methylamino)-N-(5-methyl-1,2-oxazol-3-yl)propanamide
CID 62836911
1-(4-aminophenyl)-3-(5-methyl-1,2-oxazol-3-yl)urea
CID 108812089
1-(4-chlorophenyl)-3-(4,5-dihydro-1,3-thiazol-2-yl)urea
CID 840553
N-(4,5-dihydro-1,3-thiazol-2-yl)-2-methylfuran-3-carboxamide
CID 4063650
N-(5-methyl-1,2-oxazol-3-yl)-2-(thian-4-yl)acetamide
CID 110865536
3-[(5-methyl-1,2-oxazol-3-yl)amino]-2,3-dioxopropanoic acid
CID 130735467
1-(5-methyl-1,2-oxazol-3-yl)-3-(2-methylprop-1-enyl)urea
CID 108909931
1-cyclododecyl-3-(5-methyl-1,2-oxazol-3-yl)urea
CID 108812118

Frequently Asked Questions

What is the IUPAC name of 1-(4,5-dihydro-1,3-thiazol-2-yl)-3-(5-methyl-1,2-oxazol-3-yl)urea?
The IUPAC name of 1-(4,5-dihydro-1,3-thiazol-2-yl)-3-(5-methyl-1,2-oxazol-3-yl)urea (CID 108812164) is 1-(4,5-dihydro-1,3-thiazol-2-yl)-3-(5-methyl-1,2-oxazol-3-yl)urea.
What is the SMILES notation for 1-(4,5-dihydro-1,3-thiazol-2-yl)-3-(5-methyl-1,2-oxazol-3-yl)urea?
The canonical SMILES for 1-(4,5-dihydro-1,3-thiazol-2-yl)-3-(5-methyl-1,2-oxazol-3-yl)urea is Cc1cc(NC(=O)NC2=NCCS2)no1.
What is the InChIKey of 1-(4,5-dihydro-1,3-thiazol-2-yl)-3-(5-methyl-1,2-oxazol-3-yl)urea?
The InChIKey is UJEABYCKCBYVAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4O2S/c1-5-4-6(12-14-5)10-7(13)11-8-9-2-3-15-8/h4H,2-3H2,1H3,(H2,9,10,11,12,13).
What are the key properties of 1-(4,5-dihydro-1,3-thiazol-2-yl)-3-(5-methyl-1,2-oxazol-3-yl)urea?
1-(4,5-dihydro-1,3-thiazol-2-yl)-3-(5-methyl-1,2-oxazol-3-yl)urea has a molecular weight of 226.26 g/mol, XLogP of 1.21, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,5-dihydro-1,3-thiazol-2-yl)-3-(5-methyl-1,2-oxazol-3-yl)urea is sourced from PubChem (CID 108812164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).