CS-0144957
Methyl 2-(((5R,6S,9S)-5-benzyl-1-(9H-fluoren-9-yl)-6-hydroxy-9-isobutyl-3,7,10,22-tetraoxo-2,14,17,20-tetraoxa-4,8,11,23-tetraazahexacosan-26-yl)oxy)-4-((E)-3-(3,5-di-tert-butylphenyl)-3-oxoprop-1-en-1-yl)benzoate
Manufacturer: ChemScene
CAS Number: 1351169-42-0
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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
C₆₇H₈₄N₄O₁₃
Molecular Weight
1153.40
Synonyms
None
SMILES
O=C(OCC1C2=C(C3=C1C=CC=C3)C=CC=C2)N[C@H](CC4=CC=CC=C4)[C@H](O)C(N[C@@H](CC(C)C)C(NCCOCCOCCOCC(NCCCOC5=CC(/C=C/C(C6=CC(C(C)(C)C)=CC(C(C)(C)C)=C6)=O)=CC=C5C(OC)=O)=O)=O)=O
Tpsa
226.15
Logp
9.0572
H Acceptors
13
H Donors
5
Rotatable Bonds
31
Other Options
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: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆₇H₈₄N₄O₁₃
Molecular Weight: 1153.40
Synonyms: None
SMILES: O=C(OCC1C2=C(C3=C1C=CC=C3)C=CC=C2)N[C@H](CC4=CC=CC=C4)[C@H](O)C(N[C@@H](CC(C)C)C(NCCOCCOCCOCC(NCCCOC5=CC(/C=C/C(C6=CC(C(C)(C)C)=CC(C(C)(C)C)=C6)=O)=CC=C5C(OC)=O)=O)=O)=O
Tpsa: 226.15
Logp: 9.0572
H Acceptors: 13
H Donors: 5
Rotatable Bonds: 31
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆₇H₈₄N₄O₁₃
Molecular Weight:
1153.40
Synonyms:
None
SMILES:
O=C(OCC1C2=C(C3=C1C=CC=C3)C=CC=C2)N[C@H](CC4=CC=CC=C4)[C@H](O)C(N[C@@H](CC(C)C)C(NCCOCCOCCOCC(NCCCOC5=CC(/C=C/C(C6=CC(C(C)(C)C)=CC(C(C)(C)C)=C6)=O)=CC=C5C(OC)=O)=O)=O)=O
Tpsa:
226.15
Logp:
9.0572
H Acceptors:
13
H Donors:
5
Rotatable Bonds:
31
Purity: 97%
MDL No: MFCD13561570
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₂₃Cl₂N₃
Molecular Weight: 256.22
Synonyms: 1-Methyl-4-(4-piperidinyl)piperazine dihydrochloride
SMILES: CN1CCN(C2CCNCC2)CC1.[H]Cl.[H]Cl
Tpsa: 18.51
Logp: 0.8294
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 1
Purity:
97%
MDL No:
MFCD13561570
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₂₃Cl₂N₃
Molecular Weight:
256.22
Synonyms:
1-Methyl-4-(4-piperidinyl)piperazine dihydrochloride
SMILES:
CN1CCN(C2CCNCC2)CC1.[H]Cl.[H]Cl
Tpsa:
18.51
Logp:
0.8294
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1
Purity: 97%
MDL No: MFCD27979681
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₁₃ClN₂O₂S
Molecular Weight: 344.82
Synonyms: 5-Chloro-3-(4-methylsulfonylphenyl)-2-pyridin-3-ylpyridine
SMILES: O=S(C1=CC=C(C2=CC(Cl)=CN=C2C3=CC=CN=C3)C=C1)(C)=O
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
97%
MDL No:
MFCD27979681
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₁₃ClN₂O₂S
Molecular Weight:
344.82
Synonyms:
5-Chloro-3-(4-methylsulfonylphenyl)-2-pyridin-3-ylpyridine
SMILES:
O=S(C1=CC=C(C2=CC(Cl)=CN=C2C3=CC=CN=C3)C=C1)(C)=O
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A
Purity: 97%
MDL No: MFCD13194305
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₂Cl₂FI
Molecular Weight: 290.89
Synonyms: None
SMILES: IC1=CC=C(Cl)C(Cl)=C1F
Tpsa: 0
Logp: 3.7371
H Acceptors: 0
H Donors: 0
Rotatable Bonds: 0
Purity:
97%
MDL No:
MFCD13194305
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₂Cl₂FI
Molecular Weight:
290.89
Synonyms:
None
SMILES:
IC1=CC=C(Cl)C(Cl)=C1F
Tpsa:
0
Logp:
3.7371
H Acceptors:
0
H Donors:
0
Rotatable Bonds:
0