CS-0378880
(R)-2-(2-Aminothiazol-4-yl)-N-(4-(2-((4-(2-((2-hydroxy-2-phenylethyl)amino)ethyl)phenyl)amino)-2-oxoethyl)thiazol-2-yl)acetamide hydrochloride Mirabegron Impurity
Manufacturer: ChemScene
CAS Number: None
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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
C₂₆H₂₉ClN₆O₃S₂
Molecular Weight
573.13
Synonyms
None
SMILES
O[C@@H](CNCCC1=CC=C(NC(CC2=CSC(NC(CC3=CSC(N)=N3)=O)=N2)=O)C=C1)C4=CC=CC=C4.Cl
Tpsa
142.26
Logp
3.8317
H Acceptors
9
H Donors
5
Rotatable Bonds
12
Other Options
...
SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
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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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₆H₂₉ClN₆O₃S₂
Molecular Weight: 573.13
Synonyms: None
SMILES: O[C@@H](CNCCC1=CC=C(NC(CC2=CSC(NC(CC3=CSC(N)=N3)=O)=N2)=O)C=C1)C4=CC=CC=C4.Cl
Tpsa: 142.26
Logp: 3.8317
H Acceptors: 9
H Donors: 5
Rotatable Bonds: 12
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₆H₂₉ClN₆O₃S₂
Molecular Weight:
573.13
Synonyms:
None
SMILES:
O[C@@H](CNCCC1=CC=C(NC(CC2=CSC(NC(CC3=CSC(N)=N3)=O)=N2)=O)C=C1)C4=CC=CC=C4.Cl
Tpsa:
142.26
Logp:
3.8317
H Acceptors:
9
H Donors:
5
Rotatable Bonds:
12
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₆N₂O₂
Molecular Weight: 244.29
Synonyms: S-(-)-EtoMidate
SMILES: C[C@@H](C1=CC=CC=C1)N2C(C(OCC)=O)=CN=C2
Tpsa: 44.12
Logp: 2.6691
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₆N₂O₂
Molecular Weight:
244.29
Synonyms:
S-(-)-EtoMidate
SMILES:
C[C@@H](C1=CC=CC=C1)N2C(C(OCC)=O)=CN=C2
Tpsa:
44.12
Logp:
2.6691
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₂N₂
Molecular Weight: 172.23
Synonyms: 1H-Imidazole, 1-[(1R)-1-phenylethyl]-
SMILES: C[C@H](C1=CC=CC=C1)N2C=CN=C2
Tpsa: 17.82
Logp: 2.4924
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₂N₂
Molecular Weight:
172.23
Synonyms:
1H-Imidazole, 1-[(1R)-1-phenylethyl]-
SMILES:
C[C@H](C1=CC=CC=C1)N2C=CN=C2
Tpsa:
17.82
Logp:
2.4924
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₂ClNO
Molecular Weight: 221.68
Synonyms: None
SMILES: O=C1C[C@@H](NCC#C)C2=CC=CC=C21.Cl
Tpsa: 29.1
Logp: 1.9587
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₂ClNO
Molecular Weight:
221.68
Synonyms:
None
SMILES:
O=C1C[C@@H](NCC#C)C2=CC=CC=C21.Cl
Tpsa:
29.1
Logp:
1.9587
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
2