CS-0539413

1-(Tert-butyl) 2-methyl (2S,3S,4R)-4-((3-(1,1-difluorobut-3-en-1-yl)-7-ethoxyquinoxalin-2-yl)oxy)-3-ethylpyrrolidine-1,2-dicarboxylate

Manufacturer: ChemScene

CAS Number: 1799733-69-9

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Purity

98%

MDL No

None

Storage

Sealed in dry,2-8℃

Shipping

Room temperature in continental US; may vary elsewhere.

Molecular Formula

C₂₇H₃₅F₂N₃O₆

Molecular Weight

535.58

Synonyms

(2S,3S,4R)-1-tert-butyl 2-methyl 4-((3-(1,1-difluorobut-3-en-1-yl)-7-ethoxyquinoxalin-2-yl)oxy)-3-ethylpyrrolidine-1,2-dicarboxylate

SMILES

O=C(N1[C@H](C(OC)=O)[C@H](CC)[C@@H](OC2=NC3=CC(OCC)=CC=C3N=C2C(F)(F)CC=C)C1)OC(C)(C)C

Tpsa

100.08

Logp

5.2623

H Acceptors

8

H Donors

0

Rotatable Bonds

9

SAFETY INFORMATION

Pictograms

GHS07

Signal Word

Warning

UN Number

N/A

Class

N/A

Packing Group

N/A

Hazard Statements

H302-H315-H319-H335

Precautionary Statements

P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Img

ChemScene

CS-0539413

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Purity:
98%

MDL No:
None

Storage:
Sealed in dry,2-8℃

Shipping:
Room temperature in continental US; may vary elsewhere.

Molecular Formula:
C₂₇H₃₅F₂N₃O₆

Molecular Weight:
535.58

Synonyms:
(2S,3S,4R)-1-tert-butyl 2-methyl 4-((3-(1,1-difluorobut-3-en-1-yl)-7-ethoxyquinoxalin-2-yl)oxy)-3-ethylpyrrolidine-1,2-dicarboxylate

SMILES:
O=C(N1[C@H](C(OC)=O)[C@H](CC)[C@@H](OC2=NC3=CC(OCC)=CC=C3N=C2C(F)(F)CC=C)C1)OC(C)(C)C

Tpsa:
100.08

Logp:
5.2623

H Acceptors:
8

H Donors:
0

Rotatable Bonds:
9

Img

ChemScene

CS-0539415

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Purity:
98%

MDL No:
None

Storage:
Sealed in dry,2-8℃

Shipping:
Room temperature in continental US; may vary elsewhere.

Molecular Formula:
C₂₀H₂₈N₂O₄

Molecular Weight:
360.45

Synonyms:
2,7-Diazaspiro[4.4]nonane-2,7-dicarboxylic acid, 2-(1,1-dimethylethyl) 7-(phenylmethyl) ester

SMILES:
O=C(N1CC2(CN(C(OC(C)(C)C)=O)CC2)CC1)OCC3=CC=CC=C3

Tpsa:
59.08

Logp:
3.6561

H Acceptors:
4

H Donors:
0

Rotatable Bonds:
2

Img

ChemScene

CS-0539416

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Purity:
98%

MDL No:
None

Storage:
Sealed in dry,2-8℃

Shipping:
Room temperature in continental US; may vary elsewhere.

Molecular Formula:
C₁₀H₁₁BrO₂

Molecular Weight:
243.10

Synonyms:
Benzenemethanol, 4-bromo-2-methyl-, 1-acetate

SMILES:
CC(OCC1=CC=C(Br)C=C1C)=O

Tpsa:
26.3

Logp:
2.82062

H Acceptors:
2

H Donors:
0

Rotatable Bonds:
2

Img

ChemScene

CS-0539417

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Purity:
98%

MDL No:
None

Storage:
Sealed in dry,2-8℃

Shipping:
Room temperature in continental US; may vary elsewhere.

Molecular Formula:
C₁₀H₁₁BrN₂O

Molecular Weight:
255.11

Synonyms:
None

SMILES:
O=C1CC(C)NC2=C(Br)C=CC=C2N1

Tpsa:
41.13

Logp:
2.5917

H Acceptors:
2

H Donors:
2

Rotatable Bonds:
0