7-chloro-1-ethyl-1H-pyrazolo[4,3-d]pyrimidine - CAS 923282-50-2
Catalog: |
BB040489 |
Product Name: |
7-chloro-1-ethyl-1H-pyrazolo[4,3-d]pyrimidine |
CAS: |
923282-50-2 |
Synonyms: |
7-chloro-1-ethylpyrazolo[4,3-d]pyrimidine; 7-chloro-1-ethylpyrazolo[4,3-d]pyrimidine |
IUPAC Name: | 7-chloro-1-ethylpyrazolo[4,3-d]pyrimidine |
Description: | 7-chloro-1-ethyl-1H-pyrazolo[4,3-d]pyrimidine (CAS# 923282-50-2 ) is a useful research chemical. |
Molecular Weight: | 182.611 |
Molecular Formula: | C7H7ClN4 |
Canonical SMILES: | CCN1C2=C(C=N1)N=CN=C2Cl |
InChI: | InChI=1S/C7H7ClN4/c1-2-12-6-5(3-11-12)9-4-10-7(6)8/h3-4H,2H2,1H3 |
InChI Key: | INORHSYHKNNLFD-UHFFFAOYSA-N |
LogP: | 1.49960 |
Publication Number | Title | Priority Date |
EP-2601192-A1 | Fused heterocyclic compounds | 20100804 |
EP-2601192-B1 | Fused heterocyclic compounds | 20100804 |
JP-2013534223-A | Fused heterocyclic compounds | 20100804 |
JP-5760085-B2 | Fused heterocyclic compounds | 20100804 |
US-2013172292-A1 | Fused heterocyclic compounds | 20100804 |
Complexity: | 166 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 182.0359239 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 182.0359239 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 43.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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