6-(tert-Butyl)-2,2-dimethyl-2H-benzo[b][1,4]oxazin-3(4H)-one - CAS 1267211-60-8
Catalog: |
BB006643 |
Product Name: |
6-(tert-Butyl)-2,2-dimethyl-2H-benzo[b][1,4]oxazin-3(4H)-one |
CAS: |
1267211-60-8 |
Synonyms: |
6-tert-butyl-2,2-dimethyl-4H-1,4-benzoxazin-3-one; 6-tert-butyl-2,2-dimethyl-4H-1,4-benzoxazin-3-one |
IUPAC Name: | 6-tert-butyl-2,2-dimethyl-4H-1,4-benzoxazin-3-one |
Description: | 6-(tert-Butyl)-2,2-dimethyl-2H-benzo[b][1,4]oxazin-3(4H)-one (CAS# 1267211-60-8 ) is a useful research chemical. |
Molecular Weight: | 233.31 |
Molecular Formula: | C14H19NO2 |
Canonical SMILES: | CC1(C(=O)NC2=C(O1)C=CC(=C2)C(C)(C)C)C |
InChI: | InChI=1S/C14H19NO2/c1-13(2,3)9-6-7-11-10(8-9)15-12(16)14(4,5)17-11/h6-8H,1-5H3,(H,15,16) |
InChI Key: | TVFQHQSNNRTVLO-UHFFFAOYSA-N |
Publication Number | Title | Priority Date |
US-2015031685-A1 | Substituted heterocyclic acetamides as kappa opioid receptor (kor) agonists | 20120305 |
US-2011251177-A1 | 2, 4-pyrimidinediamine compounds and prodrugs thereof and their uses | 20100413 |
US-2011003790-A1 | Pyrido [4, 3-d] pyrimidinone derivatives as kinase inhibitors | 20080201 |
US-2011003798-A1 | Compounds and compositions as kinase inhibitors | 20080201 |
US-8354526-B2 | Pyrido [4, 3-D] pyrimidinone derivatives as kinase inhibitors | 20080201 |
Complexity: | 317 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 233.141578849 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 233.141578849 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 38.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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