7-Chloro-2,3-dihydro-1,8-naphthyridin-4(1H)-one - CAS 76629-10-2
Catalog: |
BB035638 |
Product Name: |
7-Chloro-2,3-dihydro-1,8-naphthyridin-4(1H)-one |
CAS: |
76629-10-2 |
Synonyms: |
7-chloro-2,3-dihydro-1H-1,8-naphthyridin-4-one; 7-chloro-2,3-dihydro-1H-1,8-naphthyridin-4-one |
IUPAC Name: | 7-chloro-2,3-dihydro-1H-1,8-naphthyridin-4-one |
Description: | 7-Chloro-2,3-dihydro-1,8-naphthyridin-4(1H)-one (CAS# 76629-10-2) is a useful research chemical. |
Molecular Weight: | 182.61 |
Molecular Formula: | C8H7ClN2O |
Canonical SMILES: | C1CNC2=C(C1=O)C=CC(=N2)Cl |
InChI: | InChI=1S/C8H7ClN2O/c9-7-2-1-5-6(12)3-4-10-8(5)11-7/h1-2H,3-4H2,(H,10,11) |
InChI Key: | CUDIJCORCZREIG-UHFFFAOYSA-N |
LogP: | 1.87130 |
Publication Number | Title | Priority Date |
CA-2983391-A1 | Heterocyclic compound | 20150420 |
EP-3287441-A1 | Heterocyclic compound | 20150420 |
JP-6706250-B2 | Heterocyclic compound | 20150420 |
JP-WO2016171142-A1 | Heterocyclic compounds | 20150420 |
US-10189785-B2 | Heterocyclic compound | 20150420 |
Complexity: | 198 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 182.0246905 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 182.0246905 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 42 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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