CS-0803827
Tert-butyl rel-(3aS,5S,7R,7aR)-5-(3-amino-4-pyridyl)-7-methyl-2-oxo-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazole-3-carboxylate
Manufacturer: ChemScene
CAS Number: 1187056-23-0
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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
C₁₈H₂₅N₃O₄
Molecular Weight
347.41
Synonyms
None
SMILES
CC(C)(C)OC(=O)N1[C@]2([H])[C@@](OC1=O)([H])[C@H](C)C[C@H](C3C(N)=CN=CC=3)C2
Tpsa
94.75
Logp
3.3018
H Acceptors
6
H Donors
1
Rotatable Bonds
1
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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: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₂₅N₃O₄
Molecular Weight: 347.41
Synonyms: None
SMILES: CC(C)(C)OC(=O)N1[C@]2([H])[C@@](OC1=O)([H])[C@H](C)C[C@H](C3C(N)=CN=CC=3)C2
Tpsa: 94.75
Logp: 3.3018
H Acceptors: 6
H Donors: 1
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:
C₁₈H₂₅N₃O₄
Molecular Weight:
347.41
Synonyms:
None
SMILES:
CC(C)(C)OC(=O)N1[C@]2([H])[C@@](OC1=O)([H])[C@H](C)C[C@H](C3C(N)=CN=CC=3)C2
Tpsa:
94.75
Logp:
3.3018
H Acceptors:
6
H Donors:
1
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: C₁₉H₂₅N₃O₆
Molecular Weight: 391.42
Synonyms: None
SMILES: CC(=O)O[C@@H]1[C@@H](NC(=O)OC(C)(C)C)C=C(C[C@H]1C)C2C(=CN=CC=2)[N+](=O)[O-]
Tpsa: 120.66
Logp: 3.238
H Acceptors: 7
H Donors: 1
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:
C₁₉H₂₅N₃O₆
Molecular Weight:
391.42
Synonyms:
None
SMILES:
CC(=O)O[C@@H]1[C@@H](NC(=O)OC(C)(C)C)C=C(C[C@H]1C)C2C(=CN=CC=2)[N+](=O)[O-]
Tpsa:
120.66
Logp:
3.238
H Acceptors:
7
H Donors:
1
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: C₁₇H₂₃N₃O₅
Molecular Weight: 349.38
Synonyms: None
SMILES: CC(C)(C)OC(=O)N[C@@H]1[C@@H](O)[C@H](C)CC(=C1)C2C(=CN=CC=2)[N+](=O)[O-]
Tpsa: 114.59
Logp: 2.6672
H Acceptors: 6
H Donors: 2
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:
C₁₇H₂₃N₃O₅
Molecular Weight:
349.38
Synonyms:
None
SMILES:
CC(C)(C)OC(=O)N[C@@H]1[C@@H](O)[C@H](C)CC(=C1)C2C(=CN=CC=2)[N+](=O)[O-]
Tpsa:
114.59
Logp:
2.6672
H Acceptors:
6
H Donors:
2
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: C₁₃H₁₆N₂O₃
Molecular Weight: 248.28
Synonyms: None
SMILES: O=[N+]([O-])C1C(=CC=NC=1)C2CC(C)(C)CC(O)C=2
Tpsa: 76.26
Logp: 2.5541
H Acceptors: 4
H Donors: 1
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:
C₁₃H₁₆N₂O₃
Molecular Weight:
248.28
Synonyms:
None
SMILES:
O=[N+]([O-])C1C(=CC=NC=1)C2CC(C)(C)CC(O)C=2
Tpsa:
76.26
Logp:
2.5541
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2