CS-0137727
Allyl ((S)-3-(3,5-bis((tert-butyldimethylsilyl)oxy)-4-methoxyphenyl)-1-((7S,11R)-5-hydroxy-4-methyl-8-oxo-7,8,10,11-tetrahydro-6H-7,11-epimino[1,3]dioxolo[4',5':5,6]benzo[1,2-d]oxocin-12-yl)-1-oxopropan-2-yl)carbamate
Manufacturer: ChemScene
CAS Number: 265134-78-9
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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
C₃₉H₅₆N₂O₁₁Si₂
Molecular Weight
785.04
Synonyms
Carbamic acid, [(1S)-1-[[3,5-bis[[(1,1-dimethylethyl)dimethylsilyl]oxy]-4-methoxyphenyl]methyl]-2-oxo-2-[(7S,11R)-7,8,10,11-tetrahydro-5-hydroxy-4-methyl-8-oxo-6H-1,3-dioxolo[4,5-j][3]benzoxocin-7,11-imin-12-yl]ethyl]-, 2-propenyl ester (9CI)
SMILES
O=C(OCC=C)N[C@@H](CC1=CC(O[Si](C)(C(C)(C)C)C)=C(OC)C(O[Si](C)(C(C)(C)C)C)=C1)C(N2[C@@]3([H])CC(C(O)=C(C)C4=C5OCO4)=C5[C@]2([H])COC3=O)=O
Tpsa
151.32
Logp
7.08062
H Acceptors
11
H Donors
2
Rotatable Bonds
11
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: C₃₉H₅₆N₂O₁₁Si₂
Molecular Weight: 785.04
Synonyms: Carbamic acid, [(1S)-1-[[3,5-bis[[(1,1-dimethylethyl)dimethylsilyl]oxy]-4-methoxyphenyl]methyl]-2-oxo-2-[(7S,11R)-7,8,10,11-tetrahydro-5-hydroxy-4-methyl-8-oxo-6H-1,3-dioxolo[4,5-j][3]benzoxocin-7,11-imin-12-yl]ethyl]-, 2-propenyl ester (9CI)
SMILES: O=C(OCC=C)N[C@@H](CC1=CC(O[Si](C)(C(C)(C)C)C)=C(OC)C(O[Si](C)(C(C)(C)C)C)=C1)C(N2[C@@]3([H])CC(C(O)=C(C)C4=C5OCO4)=C5[C@]2([H])COC3=O)=O
Tpsa: 151.32
Logp: 7.08062
H Acceptors: 11
H Donors: 2
Rotatable Bonds: 11
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₉H₅₆N₂O₁₁Si₂
Molecular Weight:
785.04
Synonyms:
Carbamic acid, [(1S)-1-[[3,5-bis[[(1,1-dimethylethyl)dimethylsilyl]oxy]-4-methoxyphenyl]methyl]-2-oxo-2-[(7S,11R)-7,8,10,11-tetrahydro-5-hydroxy-4-methyl-8-oxo-6H-1,3-dioxolo[4,5-j][3]benzoxocin-7,11-imin-12-yl]ethyl]-, 2-propenyl ester (9CI)
SMILES:
O=C(OCC=C)N[C@@H](CC1=CC(O[Si](C)(C(C)(C)C)C)=C(OC)C(O[Si](C)(C(C)(C)C)C)=C1)C(N2[C@@]3([H])CC(C(O)=C(C)C4=C5OCO4)=C5[C@]2([H])COC3=O)=O
Tpsa:
151.32
Logp:
7.08062
H Acceptors:
11
H Donors:
2
Rotatable Bonds:
11
Purity: 97%
MDL No: MFCD11656155
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₇NO₂
Molecular Weight: 161.16
Synonyms: None
SMILES: O=[N+](C1=CC=C(C)C(C#C)=C1)[O-]
Tpsa: 43.14
Logp: 1.88452
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 1
Purity:
97%
MDL No:
MFCD11656155
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₇NO₂
Molecular Weight:
161.16
Synonyms:
None
SMILES:
O=[N+](C1=CC=C(C)C(C#C)=C1)[O-]
Tpsa:
43.14
Logp:
1.88452
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
1
Purity: 98%
MDL No: MFCD09840918
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₂₇N₃O₄
Molecular Weight: 349.42
Synonyms: ethyl 4-{5-[bis(2-hydroxyethyl)amino]-1-methyl-1H-benzimidazol-2-yl}butanoate
SMILES: O=C(OCC)CCCC1=NC2=CC(N(CCO)CCO)=CC=C2N1C
Tpsa: 87.82
Logp: 1.2501
H Acceptors: 7
H Donors: 2
Rotatable Bonds: 10
Purity:
98%
MDL No:
MFCD09840918
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₂₇N₃O₄
Molecular Weight:
349.42
Synonyms:
ethyl 4-{5-[bis(2-hydroxyethyl)amino]-1-methyl-1H-benzimidazol-2-yl}butanoate
SMILES:
O=C(OCC)CCCC1=NC2=CC(N(CCO)CCO)=CC=C2N1C
Tpsa:
87.82
Logp:
1.2501
H Acceptors:
7
H Donors:
2
Rotatable Bonds:
10
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₆H₃₂N₂O₅
Molecular Weight: 452.54
Synonyms: None
SMILES: O=C(OCC)CN1C([C@@H](N[C@H](C(OCC)=O)CCC2=CC=CC=C2)CCC3=CC=CC=C31)=O
Tpsa: 84.94
Logp: 3.0516
H Acceptors: 6
H Donors: 1
Rotatable Bonds: 10
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₆H₃₂N₂O₅
Molecular Weight:
452.54
Synonyms:
None
SMILES:
O=C(OCC)CN1C([C@@H](N[C@H](C(OCC)=O)CCC2=CC=CC=C2)CCC3=CC=CC=C31)=O
Tpsa:
84.94
Logp:
3.0516
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
10