2-(1H-imidazol-2-yl)-2-(1,2-oxazol-3-yl)-5-(1H-pyrazol-5-yl)-3-(1H-pyrrol-2-yl)-4-(2H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-1,3-oxazolidine

C23H19N9O2S — CID 141008189

IUPAC2-(1H-imidazol-2-yl)-2-(1,2-oxazol-3-yl)-5-(1H-pyrazol-5-yl)-3-(1H-pyrrol-2-yl)-4-(2H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-1,3-oxazolidine
SMILESC1=CC(C2(c3ccsn3)C(c3ccn[nH]3)OC(c3ccon3)(c3ncc[nH]3)N2c2ccc[nH]2)N=C1
InChIInChI=1S/C23H19N9O2S/c1-3-16(24-8-1)22(17-7-14-35-31-17)20(15-5-10-28-29-15)34-23(18-6-13-33-30-18,21-26-11-12-27-21)32(22)19-4-2-9-25-19/h1-14,16,20,25H,(H,26,27)(H,28,29)
InChIKeyUGGIIVGBWIHXBG-UHFFFAOYSA-N
MW485.53 g/mol
LogP3.29
Rot. Bonds6

About 2-(1H-imidazol-2-yl)-2-(1,2-oxazol-3-yl)-5-(1H-pyrazol-5-yl)-3-(1H-pyrrol-2-yl)-4-(2H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-1,3-oxazolidine

2-(1H-imidazol-2-yl)-2-(1,2-oxazol-3-yl)-5-(1H-pyrazol-5-yl)-3-(1H-pyrrol-2-yl)-4-(2H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-1,3-oxazolidine (PubChem CID 141008189) has the molecular formula C23H19N9O2S and a molecular weight of 485.53 g/mol. Its IUPAC name is 2-(1H-imidazol-2-yl)-2-(1,2-oxazol-3-yl)-5-(1H-pyrazol-5-yl)-3-(1H-pyrrol-2-yl)-4-(2H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-1,3-oxazolidine.

Molecular Properties

Compound Name2-(1H-imidazol-2-yl)-2-(1,2-oxazol-3-yl)-5-(1H-pyrazol-5-yl)-3-(1H-pyrrol-2-yl)-4-(2H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-1,3-oxazolidine
PubChem CID141008189
Molecular FormulaC23H19N9O2S
Molecular Weight485.53 g/mol
Exact Mass485.14
IUPAC Name2-(1H-imidazol-2-yl)-2-(1,2-oxazol-3-yl)-5-(1H-pyrazol-5-yl)-3-(1H-pyrrol-2-yl)-4-(2H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-1,3-oxazolidine
SMILESC1=CC(C2(c3ccsn3)C(c3ccn[nH]3)OC(c3ccon3)(c3ncc[nH]3)N2c2ccc[nH]2)N=C1
InChIInChI=1S/C23H19N9O2S/c1-3-16(24-8-1)22(17-7-14-35-31-17)20(15-5-10-28-29-15)34-23(18-6-13-33-30-18,21-26-11-12-27-21)32(22)19-4-2-9-25-19/h1-14,16,20,25H,(H,26,27)(H,28,29)
InChIKeyUGGIIVGBWIHXBG-UHFFFAOYSA-N
XLogP3.29
TPSA136.90 Ų
H-Bond Donors3
H-Bond Acceptors9
Rotatable Bonds6
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500485.53
LogP ≤ 53.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 109

Analyze 2-(1H-imidazol-2-yl)-2-(1,2-oxazol-3-yl)-5-(1H-pyrazol-5-yl)-3-(1H-pyrrol-2-yl)-4-(2H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-1,3-oxazolidine with MolForge

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Related Compounds

2-[2-(1H-imidazol-2-yl)-6-(1,2-oxazol-3-yl)-4-(1H-pyrazol-5-yl)-1-(1H-pyrrol-2-yl)-5-(1,2-thiazol-3-yl)-2H-pyridin-3-yl]-1,3-oxazole
CID 141036358
3-(furan-2-yl)-5-(1H-imidazol-2-yl)-2-(1H-pyrazol-5-yl)-3-(1H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-4-(2H-triazol-4-yl)-1,2-oxazolidine
CID 141193328
2-(1,2-oxazol-3-yl)-4-(1H-pyrazol-5-yl)-2-pyridin-2-yl-3-(1H-pyrrol-2-yl)-5-(1,2-thiazol-3-yl)-1,3-oxazole
CID 141214914

Frequently Asked Questions

What is the IUPAC name of 2-(1H-imidazol-2-yl)-2-(1,2-oxazol-3-yl)-5-(1H-pyrazol-5-yl)-3-(1H-pyrrol-2-yl)-4-(2H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-1,3-oxazolidine?
The IUPAC name of 2-(1H-imidazol-2-yl)-2-(1,2-oxazol-3-yl)-5-(1H-pyrazol-5-yl)-3-(1H-pyrrol-2-yl)-4-(2H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-1,3-oxazolidine (CID 141008189) is 2-(1H-imidazol-2-yl)-2-(1,2-oxazol-3-yl)-5-(1H-pyrazol-5-yl)-3-(1H-pyrrol-2-yl)-4-(2H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-1,3-oxazolidine.
What is the SMILES notation for 2-(1H-imidazol-2-yl)-2-(1,2-oxazol-3-yl)-5-(1H-pyrazol-5-yl)-3-(1H-pyrrol-2-yl)-4-(2H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-1,3-oxazolidine?
The canonical SMILES for 2-(1H-imidazol-2-yl)-2-(1,2-oxazol-3-yl)-5-(1H-pyrazol-5-yl)-3-(1H-pyrrol-2-yl)-4-(2H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-1,3-oxazolidine is C1=CC(C2(c3ccsn3)C(c3ccn[nH]3)OC(c3ccon3)(c3ncc[nH]3)N2c2ccc[nH]2)N=C1.
What is the InChIKey of 2-(1H-imidazol-2-yl)-2-(1,2-oxazol-3-yl)-5-(1H-pyrazol-5-yl)-3-(1H-pyrrol-2-yl)-4-(2H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-1,3-oxazolidine?
The InChIKey is UGGIIVGBWIHXBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N9O2S/c1-3-16(24-8-1)22(17-7-14-35-31-17)20(15-5-10-28-29-15)34-23(18-6-13-33-30-18,21-26-11-12-27-21)32(22)19-4-2-9-25-19/h1-14,16,20,25H,(H,26,27)(H,28,29).
What are the key properties of 2-(1H-imidazol-2-yl)-2-(1,2-oxazol-3-yl)-5-(1H-pyrazol-5-yl)-3-(1H-pyrrol-2-yl)-4-(2H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-1,3-oxazolidine?
2-(1H-imidazol-2-yl)-2-(1,2-oxazol-3-yl)-5-(1H-pyrazol-5-yl)-3-(1H-pyrrol-2-yl)-4-(2H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-1,3-oxazolidine has a molecular weight of 485.53 g/mol, XLogP of 3.29, 6 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-imidazol-2-yl)-2-(1,2-oxazol-3-yl)-5-(1H-pyrazol-5-yl)-3-(1H-pyrrol-2-yl)-4-(2H-pyrrol-2-yl)-4-(1,2-thiazol-3-yl)-1,3-oxazolidine is sourced from PubChem (CID 141008189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).