CS-0547576

2-(3-(Pyrrolidin-1-ylmethyl)-1H-indol-1-yl)acetic acid compound with acetic acid 1:1

Manufacturer: ChemScene

CAS Number: 1185301-36-3

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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

C₁₇H₂₂N₂O₄

Molecular Weight

318.37

Synonyms

(3-Pyrrolidin-1-ylmethyl-indol-1-yl)-acetic acid acetate

SMILES

CC(=O)O.C1CCN(C1)CC2=CN(C3=CC=CC=C32)CC(=O)O

Tpsa

82.77

Logp

2.4126

H Acceptors

4

H Donors

2

Rotatable Bonds

4

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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

Compare Similar Items

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Img

ChemScene

CS-0547576

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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:
C₁₇H₂₂N₂O₄

Molecular Weight:
318.37

Synonyms:
(3-Pyrrolidin-1-ylmethyl-indol-1-yl)-acetic acid acetate

SMILES:
CC(=O)O.C1CCN(C1)CC2=CN(C3=CC=CC=C32)CC(=O)O

Tpsa:
82.77

Logp:
2.4126

H Acceptors:
4

H Donors:
2

Rotatable Bonds:
4

Img

ChemScene

CS-0547577

--


Purity:
98%

MDL No:
None

Storage:
Sealed in dry,2-8℃

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

Molecular Formula:
C₈H₁₂N₂OS₂

Molecular Weight:
216.32

Synonyms:
None

SMILES:
CC(C)SCC1=CC(=O)NC(=S)N1

Tpsa:
48.65

Logp:
2.07409

H Acceptors:
3

H Donors:
2

Rotatable Bonds:
3

Img

ChemScene

CS-0547578

--


Purity:
98%

MDL No:
None

Storage:
Sealed in dry,2-8℃

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

Molecular Formula:
C₈H₁₄N₂O

Molecular Weight:
154.21

Synonyms:
None

SMILES:
NCCNC(C1=CC=CO1)C

Tpsa:
51.19

Logp:
0.8889

H Acceptors:
3

H Donors:
2

Rotatable Bonds:
4

Img

ChemScene

CS-0547579

--


Purity:
98%

MDL No:
None

Storage:
Sealed in dry,2-8℃

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

Molecular Formula:
C₁₃H₁₁Cl₂NO₄

Molecular Weight:
316.14

Synonyms:
2H-Isoindole-2-acetic acid, 5,6-dichloro-1,3-dihydro-α-(1-methylethyl)-1,3-dioxo-, (S)- (9CI)

SMILES:
CC(C)[C@@H](C(=O)O)N1C(=O)C2=CC(=C(C=C2C1=O)Cl)Cl

Tpsa:
74.68

Logp:
2.6986

H Acceptors:
3

H Donors:
1

Rotatable Bonds:
3