2-Chloro-4-(cyclopropylamino)pyrimidine-5-carboxylic Acid - CAS 1192711-37-7
Catalog: |
BB004449 |
Product Name: |
2-Chloro-4-(cyclopropylamino)pyrimidine-5-carboxylic Acid |
CAS: |
1192711-37-7 |
Synonyms: |
2-chloro-4-(cyclopropylamino)-5-pyrimidinecarboxylic acid; 2-chloro-4-(cyclopropylamino)pyrimidine-5-carboxylic acid |
IUPAC Name: | 2-chloro-4-(cyclopropylamino)pyrimidine-5-carboxylic acid |
Description: | 2-Chloro-4-(cyclopropylamino)pyrimidine-5-carboxylic Acid (CAS# 1192711-37-7 ) is a useful research chemical. |
Molecular Weight: | 213.62 |
Molecular Formula: | C8H8ClN3O2 |
Canonical SMILES: | C1CC1NC2=NC(=NC=C2C(=O)O)Cl |
InChI: | InChI=1S/C8H8ClN3O2/c9-8-10-3-5(7(13)14)6(12-8)11-4-1-2-4/h3-4H,1-2H2,(H,13,14)(H,10,11,12) |
InChI Key: | NWGFQXFVANZYHK-UHFFFAOYSA-N |
LogP: | 1.47550 |
Publication Number | Title | Priority Date |
US-2019337930-A1 | Synthesis of cerdulatinib | 20180504 |
US-10851087-B2 | Synthesis of cerdulatinib | 20180504 |
US-2021147392-A1 | Synthesis of cerdulatinib | 20180504 |
CA-2959347-A1 | Novel ulk1 inhibitors and methods using same | 20140825 |
EP-3185868-A1 | Novel ulk1 inhibitors and methods using same | 20140825 |
Complexity: | 235 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 213.0305042 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 213.0305042 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 75.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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