NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
|
ethyl (2S)-6,7-difluoro-2-methyl-10-oxo-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraene-11-carboxylate
|
|
|
IUPAC Traditional name
|
ethyl (2S)-6,7-difluoro-2-methyl-10-oxo-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraene-11-carboxylate
|
|
|
Synonyms
|
9,10-Difluoro-3-(S)-methyl-7-oxo-2,3-dihydro-7H-pyrido[1,2,3-de]-1,4-benzoxazine-6-carboxylate
|
(S)-9,10-Difluoro-2,3-dihydro-3-methyl-7-oxo-7H-pyrido[1,2,3-de]-1,4-benzoxazine-6-carboxylic Acid Ethyl Ester
|
|
|
CAS Number
|
|
PubChem SID
|
|
PubChem CID
|
|
DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
Data Source
|
Data ID
|
Price
|
TRC
|
|
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
H Acceptors
|
4
|
H Donor
|
0
|
LogD (pH = 5.5)
|
2.4819236
|
LogD (pH = 7.4)
|
2.4819236
|
Log P
|
2.4819236
|
Molar Refractivity
|
74.1913 cm3
|
Polarizability
|
27.393076 Å3
|
Polar Surface Area
|
55.84 Å2
|
Rotatable Bonds
|
3
|
Lipinski's Rule of Five
|
true
|
DETAILS
DETAILS
TRC
REFERENCES
REFERENCES
From Suppliers
Google Scholar
PubMed
Google Books
- • Traxler, P., et al.: J. Med. Chem., 42, 1018 (1999)
- • Battistutta, R., et al.: J. Biol. Chem., 275, 29618 (1999)
- • Ravi, R., et al.: Cancer Res., 62, 4180 (1999)
- • Meggio, F., et al.: Biochemistry, 43, 12931 (2004)
- Searching...Please wait...
PATENTS
PATENTS
PubChem Patent
Google Patent