CS-0674645
2-Chloro-3-((3-((1-(2,4-dichlorophenyl)pyrrolidin-3-yl)amino)-3-oxopropyl)thio)benzoic acid
Manufacturer: ChemScene
CAS Number: None
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Purity
98%
MDL No
None
Storage
4°C, protect from light, stored under nitrogen
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₀H₁₉Cl₃N₂O₃S
Molecular Weight
473.80
Synonyms
None
SMILES
O=C(NC1CCN(C1)C2=C(Cl)C=C(Cl)C=C2)CCSC3=C(Cl)C(C(O)=O)=CC=C3
Tpsa
69.64
Logp
5.2223
H Acceptors
4
H Donors
2
Rotatable Bonds
7
Other Options
...
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SAFETY INFORMATION
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: 4°C, protect from light, stored under nitrogen
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₁₉Cl₃N₂O₃S
Molecular Weight: 473.80
Synonyms: None
SMILES: O=C(NC1CCN(C1)C2=C(Cl)C=C(Cl)C=C2)CCSC3=C(Cl)C(C(O)=O)=CC=C3
Tpsa: 69.64
Logp: 5.2223
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
4°C, protect from light, stored under nitrogen
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₁₉Cl₃N₂O₃S
Molecular Weight:
473.80
Synonyms:
None
SMILES:
O=C(NC1CCN(C1)C2=C(Cl)C=C(Cl)C=C2)CCSC3=C(Cl)C(C(O)=O)=CC=C3
Tpsa:
69.64
Logp:
5.2223
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₉H₁₇Cl₃N₂O₃
Molecular Weight: 427.71
Synonyms: None
SMILES: O=C(N[C@H]1CCN(C1)C2=C(Cl)C=C(Cl)C=C2)CC3=CC=C(C(C(O)=O)=C3)Cl
Tpsa: 69.64
Logp: 4.2826
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₉H₁₇Cl₃N₂O₃
Molecular Weight:
427.71
Synonyms:
None
SMILES:
O=C(N[C@H]1CCN(C1)C2=C(Cl)C=C(Cl)C=C2)CC3=CC=C(C(C(O)=O)=C3)Cl
Tpsa:
69.64
Logp:
4.2826
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₁₄Cl₂N₄O₃S
Molecular Weight: 401.27
Synonyms: None
SMILES: NC1=C(C(O)=O)SC(C(NC2CCN(C2)C3=CC=C(C=C3Cl)Cl)=O)=N1
Tpsa: 108.55
Logp: 2.739
H Acceptors: 6
H Donors: 3
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₁₄Cl₂N₄O₃S
Molecular Weight:
401.27
Synonyms:
None
SMILES:
NC1=C(C(O)=O)SC(C(NC2CCN(C2)C3=CC=C(C=C3Cl)Cl)=O)=N1
Tpsa:
108.55
Logp:
2.739
H Acceptors:
6
H Donors:
3
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₉H₁₇Cl₄N₃O₃
Molecular Weight: 477.17
Synonyms: None
SMILES: O=C(NC1CCN(C1)C2=C(Cl)C=C(Cl)C=C2)CNC3=C(Cl)C(Cl)=C(C(O)=O)C=C3
Tpsa: 81.67
Logp: 4.8054
H Acceptors: 4
H Donors: 3
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₉H₁₇Cl₄N₃O₃
Molecular Weight:
477.17
Synonyms:
None
SMILES:
O=C(NC1CCN(C1)C2=C(Cl)C=C(Cl)C=C2)CNC3=C(Cl)C(Cl)=C(C(O)=O)C=C3
Tpsa:
81.67
Logp:
4.8054
H Acceptors:
4
H Donors:
3
Rotatable Bonds:
6