4,6-Dichloro-2-(propylthio)pyrimidin-5-amine

CAS 145783-15-9  ·  C7H9Cl2N3S  ·  MW 238.14 g/mol

Loading molecule...
3D model 4,6-Dichloro-2-(propylthio)pyrimidin-5-amine, CAS 145783-15-9, molecular formula C7H9Cl2N3S, molar mass 238.14 g/mol
About 4,6-Dichloro-2-(propylthio)pyrimidin-5-amine

4,6-Dichloro-2-(propylthio)pyrimidin-5-amine is a chemical compound registered under number CAS 145783-15-9, with the molecular formula C7H9Cl2N3S, and a molar mass of 238.14 g/mol.

The molecule contains 22 atoms connected by 22 chemical bonds. The full systematic IUPAC name of this compound is 4,6-dichloro-2-propylsulfanylpyrimidin-5-amine. The interactive 3D model above lets you view the spatial arrangement of the atoms — you can rotate it with the mouse, zoom with the scroll wheel, and switch between skeletal / Ball & Stick / Space Fill visualization modes.

In terms of physicochemical properties, the partition coefficient logP = 3.2 (positive value, a lipophilic compound), polar surface area PSA = 77.1 Ų, 1 donors and 4 hydrogen bond acceptors. These parameters are key when assessing bioavailability and interaction with biomolecules.

Chemical data for this compound comes from PubChem (NIH NLM NCBI), one of the world's largest chemical databases. All information is updated automatically and enriched with GHS hazard statement translations compliant with the CLP Regulation (EC 1272/2008). The widget above may be used for educational, research and commercial purposes.

Physicochemical properties
Molecular formulaC7H9Cl2N3S
Masa molowa238.14 g/mol
IUPAC4,6-dichloro-2-propylsulfanylpyrimidin-5-amine
SMILESCCCSC1=NC(=C(C(=N1)Cl)N)Cl
InChIKeyCJJLJBFJNXMANZ-UHFFFAOYSA-N
logP (XLogP3)3.2
PSA77.1 Ų
HBD / HBA1 / 4
PubChem CIDCID 11436336 ↗
GHS safety

Signal word: Warning

GHS07
GHS07
Scientific literature

Related literature

16 articles · 4 open access · Sources: PubMed, OpenAlex, Semantic Scholar

Filtry:Eksport:📄 BibTeX📑 RIS📋 EndNote🔧 CSL-JSON

📈 Publication timeline (16 articles)

1901: 1 articles19012011: 1 articles2015: 1 articles2019: 1 articles2020: 1 articles2021: 1 articles20212022: 1 articles2023: 2 articles2025: 4 articles2026: 2 articles2026

Bar height = number of articles per year. Hover dla szczegółów.

(2011) · Musing
Cytowania: 3$ PaywallDOI ↗

Dane z PubMed (NIH NLM), OpenAlex (CC0), Semantic Scholar (AI2). AI Summary wygenerowane przez Semantic Scholar TLDR. Artykuły z ikoną wymagają płatnego dostępu.

Synonyms
4,6-dichloro-2-(propylthio)pyrimidin-5-amine · RefChem:507976 · 808-051-8 · 145783-15-9 · 4,6-dichloro-2-propylthiopyrimidine-5-amine · 4,6-DICHLORO-2-(PROPYLSULFANYL)PYRIMIDIN-5-AMINE · 5-Amino-4,6-dichloro-2-(propylthio)pyrimidine · 5-PYRIMIDINAMINE, 4,6-DICHLORO-2-(PROPYLTHIO)- · 4,6-dichloro-2-propylsulfanylpyrimidin-5-amine · MFCD16875503 · 4,6-dichloro-2-(propylsulfanyl)-5-pyrimidinamine · Ticagrelor Impurity U · QY0S1U6LEG · SCHEMBL595428 · PB24255
Data sources
Related molecules
—
License & Provenance

MolGod 3D molecular model
4,6-Dichloro-2-(propylthio)pyrimidin-5-amine — CAS 145783-15-9

License: CC BY-SA 4.0 (source rights NIEUSTALONE — not yet granted for this model)

MolGod License & Provenance Record:
4,6-Dichloro-2-(propylthio)pyrimidin-5-amine (CAS 145783-15-9) — License & Provenance

Source:
4,6-Dichloro-2-(propylthio)pyrimidin-5-amine (CAS 145783-15-9) — MolGod molecule record

Source data: PubChem CID 11436336

STL: Download 3D model (447 KB)

SHA-256: 67294453c4786a7c69113dc8ba0652fdf5986eb65df08202d0ab2a9f0bfdbc71

Wikimedia Commons: not published yet

Source data: PubChem CID 11436336

This licence applies to the MolGod-created STL mesh, not automatically to third-party source material.