1-(4-Bromophenyl)-5-methyl-1H-pyrazole - CAS 1227958-63-5
Catalog: |
BB005523 |
Product Name: |
1-(4-Bromophenyl)-5-methyl-1H-pyrazole |
CAS: |
1227958-63-5 |
Synonyms: |
1-(4-bromophenyl)-5-methylpyrazole; 1-(4-bromophenyl)-5-methylpyrazole |
IUPAC Name: | 1-(4-bromophenyl)-5-methylpyrazole |
Description: | 1-(4-Bromophenyl)-5-methyl-1H-pyrazole (CAS# 1227958-63-5 ) is a useful research chemical. |
Molecular Weight: | 237.10 |
Molecular Formula: | C10H9BrN2 |
Canonical SMILES: | CC1=CC=NN1C2=CC=C(C=C2)Br |
InChI: | InChI=1S/C10H9BrN2/c1-8-6-7-12-13(8)10-4-2-9(11)3-5-10/h2-7H,1H3 |
InChI Key: | NXLMUQRZRCYGCO-UHFFFAOYSA-N |
LogP: | 2.94320 |
Publication Number | Title | Priority Date |
WO-2019246109-A1 | Heterocyclic compounds useful in the treatment of disease | 20180618 |
EP-3807254-A1 | Heterocyclic compounds useful in the treatment of disease | 20180618 |
KR-20210010635-A | Heterocyclic compounds useful for the treatment of diseases | 20180618 |
EP-3377493-A1 | Purinones as ubiquitin-specific protease 1 inhibitors | 20151120 |
EP-3377493-B1 | Purinones as ubiquitin-specific protease 1 inhibitors | 20151120 |
Complexity: | 166 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 235.99491 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 235.99491 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 17.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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Pyrazoles
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