CS-1001729
Resmetirom (Mgl-3196) Impurity 11
Manufacturer: ChemScene
CAS Number: 1581304-52-0
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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
C₂₀H₁₇Cl₂N₃O₃
Molecular Weight
418.27
Synonyms
None
SMILES
O=C(NC1=CC(Cl)=C(OC2=NNC(=O)C(=C2)C(C)C)C(Cl)=C1)C=3C=CC=CC3
Tpsa
84.08
Logp
5.2447
H Acceptors
4
H Donors
2
Rotatable Bonds
5
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1581304-52-0 | N-[3,5-Dichloro-4-[[1,6-dihydro-5-(1-methylethyl)-6-oxo-3-pyridazinyl]oxy]phenyl]benzamide | A2B Chem | -- |
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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: C₂₀H₁₇Cl₂N₃O₃
Molecular Weight: 418.27
Synonyms: None
SMILES: O=C(NC1=CC(Cl)=C(OC2=NNC(=O)C(=C2)C(C)C)C(Cl)=C1)C=3C=CC=CC3
Tpsa: 84.08
Logp: 5.2447
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₁₇Cl₂N₃O₃
Molecular Weight:
418.27
Synonyms:
None
SMILES:
O=C(NC1=CC(Cl)=C(OC2=NNC(=O)C(=C2)C(C)C)C(Cl)=C1)C=3C=CC=CC3
Tpsa:
84.08
Logp:
5.2447
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₄₄H₆₆N₆O₁₃
Molecular Weight: 887.03
Synonyms: None
SMILES: C(CC(N(C[C@@H](COC1=CC=C(CCC(OC[C@H]2OC(C)(C)OC2)=O)C=C1)O)CCNC(=O)N3CCOCC3)=O)C4=CC=C(OC[C@H](CNCCNC(=O)N5CCOCC5)O)C=C4
Tpsa: 219.16
Logp: 0.9279
H Acceptors: 14
H Donors: 5
Rotatable Bonds: 24
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄₄H₆₆N₆O₁₃
Molecular Weight:
887.03
Synonyms:
None
SMILES:
C(CC(N(C[C@@H](COC1=CC=C(CCC(OC[C@H]2OC(C)(C)OC2)=O)C=C1)O)CCNC(=O)N3CCOCC3)=O)C4=CC=C(OC[C@H](CNCCNC(=O)N5CCOCC5)O)C=C4
Tpsa:
219.16
Logp:
0.9279
H Acceptors:
14
H Donors:
5
Rotatable Bonds:
24
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₁NO
Molecular Weight: 185.22
Synonyms: None
SMILES: N#CC1=CCCC=2C=CC(OC)=CC12
Tpsa: 33.02
Logp: 2.54838
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₁NO
Molecular Weight:
185.22
Synonyms:
None
SMILES:
N#CC1=CCCC=2C=CC(OC)=CC12
Tpsa:
33.02
Logp:
2.54838
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₄H₈N₂O
Molecular Weight: 100.12
Synonyms: None
SMILES: O=C(N)C=C(N)C
Tpsa: 69.11
Logp: -0.6658
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄H₈N₂O
Molecular Weight:
100.12
Synonyms:
None
SMILES:
O=C(N)C=C(N)C
Tpsa:
69.11
Logp:
-0.6658
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
1