Octanex Labs | (4R,12aS)-7-methoxy-4-methyl-6,8-dioxo-3,4,6,8,12,12a-hexahydro-2H-pyri | Related Intermediates | Manufacturers & Suppliers

(4R,12aS)-7-methoxy-4-methyl-6,8-dioxo-3,4,6,8,12,12a-hexahydro-2H-pyri

Chemistry, 3 End Use API, 37 Related Intermediates

Manufacturers/Suppliers

3 Suppliers

3 Suppliers

Also known as: 1335210-34-8, (4r,12as)-7-methoxy-4-methyl-6,8-dioxo-3,4,6,8,12,12a-hexahydro-2h-pyrido[1',2':4,5]pyrazino[2,1-b][1,3]oxazine-9-carboxylic acid, Mfcd28978321, Schembl15084338, Amy30024, Zinc150055997

Molecular Formula

C₁₄H₁₆N₂O₆

Molecular Weight

308.29 g/mol

InChI Key

KGWJKKUSXSBPSK-APPZFPTMSA-N

1 2D Structure

(4R,12aS)-7-methoxy-4-methyl-6,8-dioxo-3,4,6,8,12,12a-hexahydro-2H-pyri

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

(3S,7R)-11-methoxy-7-methyl-9,12-dioxo-4-oxa-1,8-diazatricyclo[8.4.0.03,8]tetradeca-10,13-diene-13-carboxylic acid

2.1.2 InChI

InChI=1S/C14H16N2O6/c1-7-3-4-22-9-6-15-5-8(14(19)20)11(17)12(21-2)10(15)13(18)16(7)9/h5,7,9H,3-4,6H2,1-2H3,(H,19,20)/t7-,9+/m1/s1

2.1.3 InChI Key

KGWJKKUSXSBPSK-APPZFPTMSA-N

2.1.4 Canonical SMILES

CC1CCOC2N1C(=O)C3=C(C(=O)C(=CN3C2)C(=O)O)OC

2.1.5 Isomeric SMILES

C[C@@H]1CCO[C@@H]2N1C(=O)C3=C(C(=O)C(=CN3C2)C(=O)O)OC

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 1335210-34-8

2. (4r,12as)-7-methoxy-4-methyl-6,8-dioxo-3,4,6,8,12,12a-hexahydro-2h-pyrido[1',2':4,5]pyrazino[2,1-b][1,3]oxazine-9-carboxylic Acid

3. Mfcd28978321

4. Schembl15084338

5. Amy30024

6. Zinc150055997

7. Ac-30856

8. F11521

9. (4r,12as)-7-methoxy-4-methyl-6,8-dioxo-3,4,6,8,12,12a-hexahydro-2h-pyrido[1',2':4,5]pyrazino[2,1-b][1,3]-oxazine-9-carboxylic Acid

10. (4r,12as)-7-methoxy-4-methyl-6,8-dioxo-3,4,6,8,12,12a-hexahydro-2h-pyrido[1',2':4,5]pyrazino[2,1-b][1,3]oxazine-9-carboxylicacid

11. (4r,12as)-7-methoxy-4-methyl-6,8-dioxo-3,4,6,8,12,12a-hexahydro-2h-pyrido[1',2';4,5]pyrazino[2,1-b][1,3]oxazine-9-carboxylic Acid

2.3 Create Date

2015-02-13

3 Chemical and Physical Properties

Molecular Formula	C₁₄H₁₆N₂O₆
Molecular Weight	308.29 g/mol
XLogP3	0.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	2
Exact Mass	308.10083623 g/mol
Monoisotopic Mass	308.10083623 g/mol
Topological Polar Surface Area	96.4 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	623
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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CAS Number

61477-40-5

End Use API

Dolutegravir Sodium

About the Company

OctaneX Labs is a leading intermediates and Active Pharmaceutical Ingredients (API) manufacturing company...

OctaneX Labs is a leading intermediates and Active Pharmaceutical Ingredients (API) manufacturing company specializing in the development of innovative processes for the synthesis of a wide range of products. We also undertake custom pharmaceutical services and contract Research Synthesis. We are commited to create better quality of life by being at the forefront of research, manufacturing and marketing of high quality API'S.As a growing organization, we are aware that we can’t achieve our goals singly. We collaborate and work in unison with a large number of reputed and like-minded partners

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