Skip to content

4-[3-pyrazin-2-yl-2-(1H-pyrazol-5-yl)-4-pyridin-2-yl-5-(2H-tetrazol-5-yl)-4-(1,3-thiazol-2-yl)-3-(2H-triazol-4-yl)pyrazolidin-1-yl]thiadiazole

C23H17N17S2 — CID 141347783

Data last refreshed: (MolForge compound catalog, from PubChem)

IUPAC4-[3-pyrazin-2-yl-2-(1H-pyrazol-5-yl)-4-pyridin-2-yl-5-(2H-tetrazol-5-yl)-4-(1,3-thiazol-2-yl)-3-(2H-triazol-4-yl)pyrazolidin-1-yl]thiadiazole
SMILESc1ccc(C2(c3nccs3)C(c3nn[nH]n3)N(c3csnn3)N(c3ccn[nH]3)C2(c2cnccn2)c2cn[nH]n2)nc1
InChIInChI=1S/C23H17N17S2/c1-2-5-25-14(3-1)22(21-27-9-10-41-21)19(20-33-36-37-34-20)39(18-13-42-38-32-18)40(17-4-6-28-31-17)23(22,16-12-29-35-30-16)15-11-24-7-8-26-15/h1-13,19H,(H,28,31)(H,29,30,35)(H,33,34,36,37)
InChIKeyUZPXJTFFPUHRPL-UHFFFAOYSA-N
MW595.64 g/mol
LogP1.45
Rot. Bonds7

About 4-[3-pyrazin-2-yl-2-(1H-pyrazol-5-yl)-4-pyridin-2-yl-5-(2H-tetrazol-5-yl)-4-(1,3-thiazol-2-yl)-3-(2H-triazol-4-yl)pyrazolidin-1-yl]thiadiazole

4-[3-pyrazin-2-yl-2-(1H-pyrazol-5-yl)-4-pyridin-2-yl-5-(2H-tetrazol-5-yl)-4-(1,3-thiazol-2-yl)-3-(2H-triazol-4-yl)pyrazolidin-1-yl]thiadiazole (PubChem CID 141347783) has the molecular formula C23H17N17S2 and a molecular weight of 595.64 g/mol. Its IUPAC name is 4-[3-pyrazin-2-yl-2-(1H-pyrazol-5-yl)-4-pyridin-2-yl-5-(2H-tetrazol-5-yl)-4-(1,3-thiazol-2-yl)-3-(2H-triazol-4-yl)pyrazolidin-1-yl]thiadiazole.

Molecular Properties

Compound Name4-[3-pyrazin-2-yl-2-(1H-pyrazol-5-yl)-4-pyridin-2-yl-5-(2H-tetrazol-5-yl)-4-(1,3-thiazol-2-yl)-3-(2H-triazol-4-yl)pyrazolidin-1-yl]thiadiazole
PubChem CID141347783
Molecular FormulaC23H17N17S2
Molecular Weight595.64 g/mol
Exact Mass595.13
IUPAC Name4-[3-pyrazin-2-yl-2-(1H-pyrazol-5-yl)-4-pyridin-2-yl-5-(2H-tetrazol-5-yl)-4-(1,3-thiazol-2-yl)-3-(2H-triazol-4-yl)pyrazolidin-1-yl]thiadiazole
SMILESc1ccc(C2(c3nccs3)C(c3nn[nH]n3)N(c3csnn3)N(c3ccn[nH]3)C2(c2cnccn2)c2cn[nH]n2)nc1
InChIInChI=1S/C23H17N17S2/c1-2-5-25-14(3-1)22(21-27-9-10-41-21)19(20-33-36-37-34-20)39(18-13-42-38-32-18)40(17-4-6-28-31-17)23(22,16-12-29-35-30-16)15-11-24-7-8-26-15/h1-13,19H,(H,28,31)(H,29,30,35)(H,33,34,36,37)
InChIKeyUZPXJTFFPUHRPL-UHFFFAOYSA-N
XLogP1.45
TPSA208.53 Ų
H-Bond Donors3
H-Bond Acceptors16
Rotatable Bonds7
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500595.64
LogP ≤ 51.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1016

Analyze 4-[3-pyrazin-2-yl-2-(1H-pyrazol-5-yl)-4-pyridin-2-yl-5-(2H-tetrazol-5-yl)-4-(1,3-thiazol-2-yl)-3-(2H-triazol-4-yl)pyrazolidin-1-yl]thiadiazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[3-pyrazin-2-yl-2-(1H-pyrazol-5-yl)-4-pyridin-2-yl-5-(2H-tetrazol-5-yl)-4-(1,3-thiazol-2-yl)-3-(2H-triazol-4-yl)pyrazolidin-1-yl]thiadiazole?
The IUPAC name of 4-[3-pyrazin-2-yl-2-(1H-pyrazol-5-yl)-4-pyridin-2-yl-5-(2H-tetrazol-5-yl)-4-(1,3-thiazol-2-yl)-3-(2H-triazol-4-yl)pyrazolidin-1-yl]thiadiazole (CID 141347783) is 4-[3-pyrazin-2-yl-2-(1H-pyrazol-5-yl)-4-pyridin-2-yl-5-(2H-tetrazol-5-yl)-4-(1,3-thiazol-2-yl)-3-(2H-triazol-4-yl)pyrazolidin-1-yl]thiadiazole.
What is the SMILES notation for 4-[3-pyrazin-2-yl-2-(1H-pyrazol-5-yl)-4-pyridin-2-yl-5-(2H-tetrazol-5-yl)-4-(1,3-thiazol-2-yl)-3-(2H-triazol-4-yl)pyrazolidin-1-yl]thiadiazole?
The canonical SMILES for 4-[3-pyrazin-2-yl-2-(1H-pyrazol-5-yl)-4-pyridin-2-yl-5-(2H-tetrazol-5-yl)-4-(1,3-thiazol-2-yl)-3-(2H-triazol-4-yl)pyrazolidin-1-yl]thiadiazole is c1ccc(C2(c3nccs3)C(c3nn[nH]n3)N(c3csnn3)N(c3ccn[nH]3)C2(c2cnccn2)c2cn[nH]n2)nc1.
What is the InChIKey of 4-[3-pyrazin-2-yl-2-(1H-pyrazol-5-yl)-4-pyridin-2-yl-5-(2H-tetrazol-5-yl)-4-(1,3-thiazol-2-yl)-3-(2H-triazol-4-yl)pyrazolidin-1-yl]thiadiazole?
The InChIKey is UZPXJTFFPUHRPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17N17S2/c1-2-5-25-14(3-1)22(21-27-9-10-41-21)19(20-33-36-37-34-20)39(18-13-42-38-32-18)40(17-4-6-28-31-17)23(22,16-12-29-35-30-16)15-11-24-7-8-26-15/h1-13,19H,(H,28,31)(H,29,30,35)(H,33,34,36,37).
What are the key properties of 4-[3-pyrazin-2-yl-2-(1H-pyrazol-5-yl)-4-pyridin-2-yl-5-(2H-tetrazol-5-yl)-4-(1,3-thiazol-2-yl)-3-(2H-triazol-4-yl)pyrazolidin-1-yl]thiadiazole?
4-[3-pyrazin-2-yl-2-(1H-pyrazol-5-yl)-4-pyridin-2-yl-5-(2H-tetrazol-5-yl)-4-(1,3-thiazol-2-yl)-3-(2H-triazol-4-yl)pyrazolidin-1-yl]thiadiazole has a molecular weight of 595.64 g/mol, XLogP of 1.45, 7 rotatable bonds, 3 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-pyrazin-2-yl-2-(1H-pyrazol-5-yl)-4-pyridin-2-yl-5-(2H-tetrazol-5-yl)-4-(1,3-thiazol-2-yl)-3-(2H-triazol-4-yl)pyrazolidin-1-yl]thiadiazole is sourced from PubChem (CID 141347783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Browse: Molecules A–Z · all molecules A–Z · drugs A–Z · protein targets A–Z.

Sources

How this page is built: methodology · editorial policy & corrections.

For research and educational use only — not medical advice. This page is compiled automatically from public databases. It is not written or reviewed by a clinician. Do not start, stop or change any treatment based on it; consult a qualified healthcare professional. Spotted an error? See our corrections policy or email hello@molforge.ai.