CS-1003170
Topiroxostat Impurity 71
Manufacturer: ChemScene
CAS Number: 25077-99-0
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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
C₁₀H₁₄O₃S
Molecular Weight
214.28
Synonyms
None
SMILES
O=S(=O)(OC1=CC=C(C=C1)C)C(C)C
Tpsa
43.37
Logp
2.11202
H Acceptors
3
H Donors
0
Rotatable Bonds
3
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: C₁₀H₁₄O₃S
Molecular Weight: 214.28
Synonyms: None
SMILES: O=S(=O)(OC1=CC=C(C=C1)C)C(C)C
Tpsa: 43.37
Logp: 2.11202
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₄O₃S
Molecular Weight:
214.28
Synonyms:
None
SMILES:
O=S(=O)(OC1=CC=C(C=C1)C)C(C)C
Tpsa:
43.37
Logp:
2.11202
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₃H₂₉N₃O₂
Molecular Weight: 379.50
Synonyms: None
SMILES: O=C(NC=1C(=CC=CC1C)C)C2N(C=3C=CC=CC3C)C(=O)C(N2CCC)C
Tpsa: 52.65
Logp: 4.02376
H Acceptors: 3
H Donors: 1
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:
C₂₃H₂₉N₃O₂
Molecular Weight:
379.50
Synonyms:
None
SMILES:
O=C(NC=1C(=CC=CC1C)C)C2N(C=3C=CC=CC3C)C(=O)C(N2CCC)C
Tpsa:
52.65
Logp:
4.02376
H Acceptors:
3
H Donors:
1
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: C₅H₁₂ClNO₃
Molecular Weight: 169.61
Synonyms: None
SMILES: Cl.O=C(O)C(O)CCCN
Tpsa: 83.55
Logp: -0.4074
H Acceptors: 3
H Donors: 3
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:
C₅H₁₂ClNO₃
Molecular Weight:
169.61
Synonyms:
None
SMILES:
Cl.O=C(O)C(O)CCCN
Tpsa:
83.55
Logp:
-0.4074
H Acceptors:
3
H Donors:
3
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: C₂₄H₃₂O₆
Molecular Weight: 416.51
Synonyms: None
SMILES: C(CO)(=O)[C@]12[C@]3(C)[C@@](C[C@]1(OC(C)(C)O2)[H])([C@]4([C@]([C@H](O)C3)([C@]5(C)C(CC4)=CC(=O)C=C5)[H])[H])[H]
Tpsa: 93.06
Logp: 2.3267
H Acceptors: 6
H Donors: 2
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:
C₂₄H₃₂O₆
Molecular Weight:
416.51
Synonyms:
None
SMILES:
C(CO)(=O)[C@]12[C@]3(C)[C@@](C[C@]1(OC(C)(C)O2)[H])([C@]4([C@]([C@H](O)C3)([C@]5(C)C(CC4)=CC(=O)C=C5)[H])[H])[H]
Tpsa:
93.06
Logp:
2.3267
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
2