FQANRKMEXUZLPB-UHFFFAOYSA-N

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

C₂₄H₂₃ClN₄O₄ — CID 118875489

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

IUPAC5-[(4-chlorophenyl)methyl]-3-(3-hydroxypropyl)-1-methyl-6-[(5-methyl-3-pyridinyl)oxy]pyrido[2,3-d]pyrimidine-2,4-dione

SMILESCc1cncc(Oc2cnc3c(c2Cc2ccc(Cl)cc2)c(=O)n(CCCO)c(=O)n3C)c1

InChIInChI=1S/C24H23ClN4O4/c1-15-10-18(13-26-12-15)33-20-14-27-22-21(19(20)11-16-4-6-17(25)7-5-16)23(31)29(8-3-9-30)24(32)28(22)2/h4-7,10,12-14,30H,3,8-9,11H2,1-2H3

InChIKeyFQANRKMEXUZLPB-UHFFFAOYSA-N

MW466.93 g/mol

LogP3.22

Rot. Bonds7

About FQANRKMEXUZLPB-UHFFFAOYSA-N

FQANRKMEXUZLPB-UHFFFAOYSA-N (PubChem CID 118875489) has the molecular formula C₂₄H₂₃ClN₄O₄ and a molecular weight of 466.93 g/mol. Its IUPAC name is 5-[(4-chlorophenyl)methyl]-3-(3-hydroxypropyl)-1-methyl-6-[(5-methyl-3-pyridinyl)oxy]pyrido[2,3-d]pyrimidine-2,4-dione.

Molecular Properties

Compound Name	FQANRKMEXUZLPB-UHFFFAOYSA-N
PubChem CID	118875489
Molecular Formula	C₂₄H₂₃ClN₄O₄
Molecular Weight	466.93 g/mol
Exact Mass	466.14
IUPAC Name	5-[(4-chlorophenyl)methyl]-3-(3-hydroxypropyl)-1-methyl-6-[(5-methyl-3-pyridinyl)oxy]pyrido[2,3-d]pyrimidine-2,4-dione
SMILES	Cc1cncc(Oc2cnc3c(c2Cc2ccc(Cl)cc2)c(=O)n(CCCO)c(=O)n3C)c1
InChI	InChI=1S/C24H23ClN4O4/c1-15-10-18(13-26-12-15)33-20-14-27-22-21(19(20)11-16-4-6-17(25)7-5-16)23(31)29(8-3-9-30)24(32)28(22)2/h4-7,10,12-14,30H,3,8-9,11H2,1-2H3
InChIKey	FQANRKMEXUZLPB-UHFFFAOYSA-N
XLogP	3.22
TPSA	99.24 Å²
H-Bond Donors	1
H-Bond Acceptors	8
Rotatable Bonds	7
Heavy Atoms	33
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	466.93
LogP ≤ 5	3.22
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

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

The IUPAC name of FQANRKMEXUZLPB-UHFFFAOYSA-N (CID 118875489) is 5-[(4-chlorophenyl)methyl]-3-(3-hydroxypropyl)-1-methyl-6-[(5-methyl-3-pyridinyl)oxy]pyrido[2,3-d]pyrimidine-2,4-dione.

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

The canonical SMILES for FQANRKMEXUZLPB-UHFFFAOYSA-N is Cc1cncc(Oc2cnc3c(c2Cc2ccc(Cl)cc2)c(=O)n(CCCO)c(=O)n3C)c1.

What is the InChIKey of FQANRKMEXUZLPB-UHFFFAOYSA-N?

The InChIKey is FQANRKMEXUZLPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23ClN4O4/c1-15-10-18(13-26-12-15)33-20-14-27-22-21(19(20)11-16-4-6-17(25)7-5-16)23(31)29(8-3-9-30)24(32)28(22)2/h4-7,10,12-14,30H,3,8-9,11H2,1-2H3.

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

FQANRKMEXUZLPB-UHFFFAOYSA-N has a molecular weight of 466.93 g/mol, XLogP of 3.22, 7 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for FQANRKMEXUZLPB-UHFFFAOYSA-N is sourced from PubChem (CID 118875489), 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 118875489 — identifiers, structure, computed properties (public domain)

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