5-imidazolidin-1-yl-2-(1H-imidazol-2-yl)-4-(1H-pyrazol-5-yl)-4-(2H-tetrazol-5-yl)-2-(1,3-thiazolidin-2-yl)-3-(1,3-thiazol-2-yl)-1,3-oxazolidine

C19H23N13OS2 — CID 140994219

IUPAC5-imidazolidin-1-yl-2-(1H-imidazol-2-yl)-4-(1H-pyrazol-5-yl)-4-(2H-tetrazol-5-yl)-2-(1,3-thiazolidin-2-yl)-3-(1,3-thiazol-2-yl)-1,3-oxazolidine
SMILESc1cc(C2(c3nn[nH]n3)C(N3CCNC3)OC(c3ncc[nH]3)(C3NCCS3)N2c2nccs2)[nH]n1
InChIInChI=1S/C19H23N13OS2/c1-2-25-26-12(1)18(13-27-29-30-28-13)16(31-8-5-20-11-31)33-19(14-21-3-4-22-14,15-23-6-9-34-15)32(18)17-24-7-10-35-17/h1-4,7,10,15-16,20,23H,5-6,8-9,11H2,(H,21,22)(H,25,26)(H,27,28,29,30)
InChIKeyBVSRRQIJGVKDAF-UHFFFAOYSA-N
MW513.62 g/mol
LogP-0.41
Rot. Bonds6

About 5-imidazolidin-1-yl-2-(1H-imidazol-2-yl)-4-(1H-pyrazol-5-yl)-4-(2H-tetrazol-5-yl)-2-(1,3-thiazolidin-2-yl)-3-(1,3-thiazol-2-yl)-1,3-oxazolidine

5-imidazolidin-1-yl-2-(1H-imidazol-2-yl)-4-(1H-pyrazol-5-yl)-4-(2H-tetrazol-5-yl)-2-(1,3-thiazolidin-2-yl)-3-(1,3-thiazol-2-yl)-1,3-oxazolidine (PubChem CID 140994219) has the molecular formula C19H23N13OS2 and a molecular weight of 513.62 g/mol. Its IUPAC name is 5-imidazolidin-1-yl-2-(1H-imidazol-2-yl)-4-(1H-pyrazol-5-yl)-4-(2H-tetrazol-5-yl)-2-(1,3-thiazolidin-2-yl)-3-(1,3-thiazol-2-yl)-1,3-oxazolidine.

Molecular Properties

Compound Name5-imidazolidin-1-yl-2-(1H-imidazol-2-yl)-4-(1H-pyrazol-5-yl)-4-(2H-tetrazol-5-yl)-2-(1,3-thiazolidin-2-yl)-3-(1,3-thiazol-2-yl)-1,3-oxazolidine
PubChem CID140994219
Molecular FormulaC19H23N13OS2
Molecular Weight513.62 g/mol
Exact Mass513.16
IUPAC Name5-imidazolidin-1-yl-2-(1H-imidazol-2-yl)-4-(1H-pyrazol-5-yl)-4-(2H-tetrazol-5-yl)-2-(1,3-thiazolidin-2-yl)-3-(1,3-thiazol-2-yl)-1,3-oxazolidine
SMILESc1cc(C2(c3nn[nH]n3)C(N3CCNC3)OC(c3ncc[nH]3)(C3NCCS3)N2c2nccs2)[nH]n1
InChIInChI=1S/C19H23N13OS2/c1-2-25-26-12(1)18(13-27-29-30-28-13)16(31-8-5-20-11-31)33-19(14-21-3-4-22-14,15-23-6-9-34-15)32(18)17-24-7-10-35-17/h1-4,7,10,15-16,20,23H,5-6,8-9,11H2,(H,21,22)(H,25,26)(H,27,28,29,30)
InChIKeyBVSRRQIJGVKDAF-UHFFFAOYSA-N
XLogP-0.41
TPSA164.48 Ų
H-Bond Donors5
H-Bond Acceptors13
Rotatable Bonds6
Heavy Atoms35
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500513.62
LogP ≤ 5-0.41
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1013

Analyze 5-imidazolidin-1-yl-2-(1H-imidazol-2-yl)-4-(1H-pyrazol-5-yl)-4-(2H-tetrazol-5-yl)-2-(1,3-thiazolidin-2-yl)-3-(1,3-thiazol-2-yl)-1,3-oxazolidine with MolForge

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Launch Full Analysis

Related Compounds

methane;bis(2-propan-2-yl-1H-imidazole);5-propan-2-yl-1H-pyrazole;2-propan-2-yl-1,3-thiazole;5-propan-2-yl-1H-1,2,4-triazole
CID 158395781
bis(2-propan-2-yl-1H-imidazole);5-propan-2-yl-1H-pyrazole;2-propan-2-yl-1,3-thiazole;5-propan-2-yl-1H-1,2,4-triazole
CID 159493460

Frequently Asked Questions

What is the IUPAC name of 5-imidazolidin-1-yl-2-(1H-imidazol-2-yl)-4-(1H-pyrazol-5-yl)-4-(2H-tetrazol-5-yl)-2-(1,3-thiazolidin-2-yl)-3-(1,3-thiazol-2-yl)-1,3-oxazolidine?
The IUPAC name of 5-imidazolidin-1-yl-2-(1H-imidazol-2-yl)-4-(1H-pyrazol-5-yl)-4-(2H-tetrazol-5-yl)-2-(1,3-thiazolidin-2-yl)-3-(1,3-thiazol-2-yl)-1,3-oxazolidine (CID 140994219) is 5-imidazolidin-1-yl-2-(1H-imidazol-2-yl)-4-(1H-pyrazol-5-yl)-4-(2H-tetrazol-5-yl)-2-(1,3-thiazolidin-2-yl)-3-(1,3-thiazol-2-yl)-1,3-oxazolidine.
What is the SMILES notation for 5-imidazolidin-1-yl-2-(1H-imidazol-2-yl)-4-(1H-pyrazol-5-yl)-4-(2H-tetrazol-5-yl)-2-(1,3-thiazolidin-2-yl)-3-(1,3-thiazol-2-yl)-1,3-oxazolidine?
The canonical SMILES for 5-imidazolidin-1-yl-2-(1H-imidazol-2-yl)-4-(1H-pyrazol-5-yl)-4-(2H-tetrazol-5-yl)-2-(1,3-thiazolidin-2-yl)-3-(1,3-thiazol-2-yl)-1,3-oxazolidine is c1cc(C2(c3nn[nH]n3)C(N3CCNC3)OC(c3ncc[nH]3)(C3NCCS3)N2c2nccs2)[nH]n1.
What is the InChIKey of 5-imidazolidin-1-yl-2-(1H-imidazol-2-yl)-4-(1H-pyrazol-5-yl)-4-(2H-tetrazol-5-yl)-2-(1,3-thiazolidin-2-yl)-3-(1,3-thiazol-2-yl)-1,3-oxazolidine?
The InChIKey is BVSRRQIJGVKDAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N13OS2/c1-2-25-26-12(1)18(13-27-29-30-28-13)16(31-8-5-20-11-31)33-19(14-21-3-4-22-14,15-23-6-9-34-15)32(18)17-24-7-10-35-17/h1-4,7,10,15-16,20,23H,5-6,8-9,11H2,(H,21,22)(H,25,26)(H,27,28,29,30).
What are the key properties of 5-imidazolidin-1-yl-2-(1H-imidazol-2-yl)-4-(1H-pyrazol-5-yl)-4-(2H-tetrazol-5-yl)-2-(1,3-thiazolidin-2-yl)-3-(1,3-thiazol-2-yl)-1,3-oxazolidine?
5-imidazolidin-1-yl-2-(1H-imidazol-2-yl)-4-(1H-pyrazol-5-yl)-4-(2H-tetrazol-5-yl)-2-(1,3-thiazolidin-2-yl)-3-(1,3-thiazol-2-yl)-1,3-oxazolidine has a molecular weight of 513.62 g/mol, XLogP of -0.41, 6 rotatable bonds, 5 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 5-imidazolidin-1-yl-2-(1H-imidazol-2-yl)-4-(1H-pyrazol-5-yl)-4-(2H-tetrazol-5-yl)-2-(1,3-thiazolidin-2-yl)-3-(1,3-thiazol-2-yl)-1,3-oxazolidine is sourced from PubChem (CID 140994219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).