1'H-Spiro[piperidine-4,4'-quinazolin]-2'(3'H)-one - CAS 635713-68-7
Catalog: |
BB032200 |
Product Name: |
1'H-Spiro[piperidine-4,4'-quinazolin]-2'(3'H)-one |
CAS: |
635713-68-7 |
Synonyms: |
2-spiro[1,3-dihydroquinazoline-4,4'-piperidine]one; spiro[1,3-dihydroquinazoline-4,4'-piperidine]-2-one |
IUPAC Name: | spiro[1,3-dihydroquinazoline-4,4'-piperidine]-2-one |
Description: | 1'H-Spiro[piperidine-4,4'-quinazolin]-2'(3'H)-one (CAS# 635713-68-7) is a useful research chemical. |
Molecular Weight: | 217.27 |
Molecular Formula: | C12H15N3O |
Canonical SMILES: | C1CNCCC12C3=CC=CC=C3NC(=O)N2 |
InChI: | InChI=1S/C12H15N3O/c16-11-14-10-4-2-1-3-9(10)12(15-11)5-7-13-8-6-12/h1-4,13H,5-8H2,(H2,14,15,16) |
InChI Key: | CFLDCJYCZAHJCK-UHFFFAOYSA-N |
Boiling Point: | 371.299 °C at 760 mmHg |
Density: | 1.268 g/cm3 |
LogP: | 1.50720 |
Publication Number | Title | Priority Date |
WO-2020216378-A1 | Heterocyclic compound, application thereof, and composition containing same | 20190426 |
JP-2013523792-A | Pharmaceutical combination containing a PDE4 inhibitor and an EP4 receptor antagonist | 20100408 |
JP-2012519160-A | Combination drug containing PDE4 inhibitor and NSAID | 20090227 |
EP-2265588-A1 | INHIBITORS OF 11ß -HYDROXYSTEROID DEHYDROGENASE TYPE 1 | 20080227 |
EP-2265588-B1 | INHIBITORS OF 11ß -HYDROXYSTEROID DEHYDROGENASE TYPE 1 | 20080227 |
Complexity: | 286 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 217.12151211 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 217.12151211 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 53.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.4 |
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