CS-0666037

(2R,3R)-2,3-bis((4-methylbenzoyl)oxy)succinate ,rel-(3S,4S)-1-benzyl-N,4-dimethylpiperidin-3-amine(1:2)

Manufacturer: ChemScene

CAS Number: 493040-24-7

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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

C₄₈H₆₂N₄O₈

Molecular Weight

823.03

Synonyms

None

SMILES

O=C(C1=CC=C(C=C1)C)O[C@@H](C(O)=O)[C@H](C(O)=O)OC(C2=CC=C(C=C2)C)=O.CN[C@@H]([C@H](CC3)C)CN3CC4=CC=CC=C4.CN[C@@H]([C@H](CC5)C)CN5CC6=CC=CC=C6

Tpsa

157.74

Logp

6.45644

H Acceptors

10

H Donors

4

Rotatable Bonds

13

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-P280-P302+P352

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ChemScene

CS-0666037

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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:
C₄₈H₆₂N₄O₈

Molecular Weight:
823.03

Synonyms:
None

SMILES:
O=C(C1=CC=C(C=C1)C)O[C@@H](C(O)=O)[C@H](C(O)=O)OC(C2=CC=C(C=C2)C)=O.CN[C@@H]([C@H](CC3)C)CN3CC4=CC=CC=C4.CN[C@@H]([C@H](CC5)C)CN5CC6=CC=CC=C6

Tpsa:
157.74

Logp:
6.45644

H Acceptors:
10

H Donors:
4

Rotatable Bonds:
13

Img

ChemScene

CS-0666038

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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:
C₈H₉N₃

Molecular Weight:
147.18

Synonyms:
None

SMILES:
CC1=CC=CN2C1=NC(=N2)C

Tpsa:
30.19

Logp:
1.34614

H Acceptors:
3

H Donors:
0

Rotatable Bonds:
0

Img

ChemScene

CS-0666039

--


Purity:
98%

MDL No:
None

Storage:
Sealed in dry,2-8℃

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

Molecular Formula:
C₅H₇Br

Molecular Weight:
147.01

Synonyms:
None

SMILES:
C=C1CC(C1)Br

Tpsa:
0

Logp:
2.0999

H Acceptors:
0

H Donors:
0

Rotatable Bonds:
0

Img

ChemScene

CS-0666040

--


Purity:
98%

MDL No:
None

Storage:
Sealed in dry,2-8℃

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

Molecular Formula:
C₅H₈O

Molecular Weight:
84.12

Synonyms:
None

SMILES:
C1C2C1(C2)CO

Tpsa:
20.23

Logp:
0.3887

H Acceptors:
1

H Donors:
1

Rotatable Bonds:
1