2,4,6-Trichloro-5-isopropylpyrimidine - CAS 1780-42-3
Catalog: |
BB013385 |
Product Name: |
2,4,6-Trichloro-5-isopropylpyrimidine |
CAS: |
1780-42-3 |
Synonyms: |
2,4,6-trichloro-5-propan-2-ylpyrimidine; 2,4,6-trichloro-5-propan-2-ylpyrimidine |
IUPAC Name: | 2,4,6-trichloro-5-propan-2-ylpyrimidine |
Description: | 2,4,6-Trichloro-5-isopropylpyrimidine (CAS# 1780-42-3 ) is a useful research chemical. |
Molecular Weight: | 225.50 |
Molecular Formula: | C7H7Cl3N2 |
Canonical SMILES: | CC(C)C1=C(N=C(N=C1Cl)Cl)Cl |
InChI: | InChI=1S/C7H7Cl3N2/c1-3(2)4-5(8)11-7(10)12-6(4)9/h3H,1-2H3 |
InChI Key: | YVPSTWNQGHUOJP-UHFFFAOYSA-N |
Boiling Point: | 243.8 ℃ at 760 mmHg |
Density: | 1.393 g/cm3 |
LogP: | 3.56020 |
Publication Number | Title | Priority Date |
US-2019135793-A1 | Heterocyclic inhibitors of kdm5 for the treatment of disease | 20170518 |
WO-2018213777-A1 | Heterocyclic inhibitors of kdm5 for the treatment of disease | 20170518 |
WO-2012092880-A1 | 2,4-DIAMINO-6,7-DIHYDRO-5H-PYRROLO[2,3]PYRIMIDINE DERIVATIVES AS FAK/Pyk2 INHIBITORS | 20110107 |
KR-20100092960-A | Method for preparing HIV reverse transcriptase inhibitor | 20071221 |
US-2009163712-A1 | Processes for preparing hiv reverse transcriptase inhibitors | 20071221 |
Complexity: | 142 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 223.967481 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 223.967481 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 25.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.2 |
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