CS-0133915

tert-Butyl 4-(3-bromo-5-oxo-4,5-dihydropyrazolo[1,5-a]pyrimidin-7-yl)piperidine-1-carboxylate

Manufacturer: ChemScene

CAS Number: 1923811-12-4

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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

C₁₆H₂₁BrN₄O₃

Molecular Weight

397.27

Synonyms

1-Piperidinecarboxylic acid, 4-(3-bromo-4,5-dihydro-5-oxopyrazolo[1,5-a]pyrimidin-7-yl)-, 1,1-dimethylethyl ester

SMILES

O=C(N1CCC(C2=CC(NC3=C(Br)C=NN23)=O)CC1)OC(C)(C)C

Tpsa

79.7

Logp

2.8996

H Acceptors

5

H Donors

1

Rotatable Bonds

1

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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ChemScene

CS-0133915

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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:
C₁₆H₂₁BrN₄O₃

Molecular Weight:
397.27

Synonyms:
1-Piperidinecarboxylic acid, 4-(3-bromo-4,5-dihydro-5-oxopyrazolo[1,5-a]pyrimidin-7-yl)-, 1,1-dimethylethyl ester

SMILES:
O=C(N1CCC(C2=CC(NC3=C(Br)C=NN23)=O)CC1)OC(C)(C)C

Tpsa:
79.7

Logp:
2.8996

H Acceptors:
5

H Donors:
1

Rotatable Bonds:
1

Img

ChemScene

CS-0133916

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Purity:
95%

MDL No:
None

Storage:
Sealed in dry,2-8℃

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

Molecular Formula:
C₁₀H₁₈ClNO₂

Molecular Weight:
219.71

Synonyms:
None

SMILES:
O=C(C1C(CCC2)C2NCC1)OC.[H]Cl

Tpsa:
38.33

Logp:
1.3594

H Acceptors:
3

H Donors:
1

Rotatable Bonds:
1

Img

ChemScene

CS-0133917

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Purity:
97%

MDL No:
MFCD20662817

Storage:
4°C, protect from light

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

Molecular Formula:
C₄H₁₀N₂O₂S

Molecular Weight:
150.20

Synonyms:
Hexahydro-1,2,5-thiadiazepine 1,1-dioxide

SMILES:
O=S1(NCCNCC1)=O

Tpsa:
58.2

Logp:
-1.491

H Acceptors:
3

H Donors:
2

Rotatable Bonds:
0

Img

ChemScene

CS-0133919

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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:
C₁₃H₁₅F₃O

Molecular Weight:
244.25

Synonyms:
None

SMILES:
OCC1=CC=C(C2CCCC2)C(C(F)(F)F)=C1

Tpsa:
20.23

Logp:
3.8553

H Acceptors:
1

H Donors:
1

Rotatable Bonds:
2