RXZOZRYGPGQTST-UHFFFAOYSA-N

Name: RXZOZRYGPGQTST-UHFFFAOYSA-N — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₂₂H₁₅F₂N₅O₄ — CID 155730255

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC3-[[5-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]-2-pyridinyl]methyl]-7-(furan-2-yl)-1-methylquinazoline-2,4-dione

SMILESCn1c(=O)n(Cc2ccc(-c3nnc(C(F)F)o3)cn2)c(=O)c2ccc(-c3ccco3)cc21

InChIInChI=1S/C22H15F2N5O4/c1-28-16-9-12(17-3-2-8-32-17)5-7-15(16)21(30)29(22(28)31)11-14-6-4-13(10-25-14)19-26-27-20(33-19)18(23)24/h2-10,18H,11H2,1H3

InChIKeyRXZOZRYGPGQTST-UHFFFAOYSA-N

MW451.39 g/mol

LogP3.39

Rot. Bonds5

About RXZOZRYGPGQTST-UHFFFAOYSA-N

RXZOZRYGPGQTST-UHFFFAOYSA-N (PubChem CID 155730255) has the molecular formula C₂₂H₁₅F₂N₅O₄ and a molecular weight of 451.39 g/mol. Its IUPAC name is 3-[[5-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]-2-pyridinyl]methyl]-7-(furan-2-yl)-1-methylquinazoline-2,4-dione.

Molecular Properties

Compound Name	RXZOZRYGPGQTST-UHFFFAOYSA-N
PubChem CID	155730255
Molecular Formula	C₂₂H₁₅F₂N₅O₄
Molecular Weight	451.39 g/mol
Exact Mass	451.11
IUPAC Name	3-[[5-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]-2-pyridinyl]methyl]-7-(furan-2-yl)-1-methylquinazoline-2,4-dione
SMILES	Cn1c(=O)n(Cc2ccc(-c3nnc(C(F)F)o3)cn2)c(=O)c2ccc(-c3ccco3)cc21
InChI	InChI=1S/C22H15F2N5O4/c1-28-16-9-12(17-3-2-8-32-17)5-7-15(16)21(30)29(22(28)31)11-14-6-4-13(10-25-14)19-26-27-20(33-19)18(23)24/h2-10,18H,11H2,1H3
InChIKey	RXZOZRYGPGQTST-UHFFFAOYSA-N
XLogP	3.39
TPSA	108.95 Å²
H-Bond Donors
H-Bond Acceptors	9
Rotatable Bonds	5
Heavy Atoms	33
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	451.39
LogP ≤ 5	3.39
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	9

Frequently Asked Questions

What is the IUPAC name of RXZOZRYGPGQTST-UHFFFAOYSA-N?

The IUPAC name of RXZOZRYGPGQTST-UHFFFAOYSA-N (CID 155730255) is 3-[[5-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]-2-pyridinyl]methyl]-7-(furan-2-yl)-1-methylquinazoline-2,4-dione.

What is the SMILES notation for RXZOZRYGPGQTST-UHFFFAOYSA-N?

The canonical SMILES for RXZOZRYGPGQTST-UHFFFAOYSA-N is Cn1c(=O)n(Cc2ccc(-c3nnc(C(F)F)o3)cn2)c(=O)c2ccc(-c3ccco3)cc21.

What is the InChIKey of RXZOZRYGPGQTST-UHFFFAOYSA-N?

The InChIKey is RXZOZRYGPGQTST-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15F2N5O4/c1-28-16-9-12(17-3-2-8-32-17)5-7-15(16)21(30)29(22(28)31)11-14-6-4-13(10-25-14)19-26-27-20(33-19)18(23)24/h2-10,18H,11H2,1H3.

What are the key properties of RXZOZRYGPGQTST-UHFFFAOYSA-N?

RXZOZRYGPGQTST-UHFFFAOYSA-N has a molecular weight of 451.39 g/mol, XLogP of 3.39, 5 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for RXZOZRYGPGQTST-UHFFFAOYSA-N is sourced from PubChem (CID 155730255), 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

PubChem CID 155730255 — identifiers, structure, computed properties (public domain)

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