CS-0644366
(6R,7R)-7-Amino-8-oxo-3-(((3-oxobutanoyl)oxy)methyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Manufacturer: ChemScene
CAS Number: 61607-36-1
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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
C₁₂H₁₄N₂O₆S
Molecular Weight
314.31
Synonyms
None
SMILES
O=C(C(N12)=C(COC(CC(C)=O)=O)CS[C@]2([H])[C@H](N)C1=O)O
Tpsa
127
Logp
-0.9102
H Acceptors
7
H Donors
2
Rotatable Bonds
5
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: C₁₂H₁₄N₂O₆S
Molecular Weight: 314.31
Synonyms: None
SMILES: O=C(C(N12)=C(COC(CC(C)=O)=O)CS[C@]2([H])[C@H](N)C1=O)O
Tpsa: 127
Logp: -0.9102
H Acceptors: 7
H Donors: 2
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:
C₁₂H₁₄N₂O₆S
Molecular Weight:
314.31
Synonyms:
None
SMILES:
O=C(C(N12)=C(COC(CC(C)=O)=O)CS[C@]2([H])[C@H](N)C1=O)O
Tpsa:
127
Logp:
-0.9102
H Acceptors:
7
H Donors:
2
Rotatable Bonds:
5
Purity: 97%
MDL No: None
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₂₅N₅
Molecular Weight: 335.45
Synonyms: None
SMILES: N#CNC(C1=NC(C2=NC=CC(C(C)(C)C)=C2)=CC(C(C)(C)C)=C1)=N
Tpsa: 85.45
Logp: 4.13465
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 2
Purity:
97%
MDL No:
None
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₂₅N₅
Molecular Weight:
335.45
Synonyms:
None
SMILES:
N#CNC(C1=NC(C2=NC=CC(C(C)(C)C)=C2)=CC(C(C)(C)C)=C1)=N
Tpsa:
85.45
Logp:
4.13465
H Acceptors:
4
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: C₂₂H₃₂N₂O₄
Molecular Weight: 388.50
Synonyms: None
SMILES: C=C[C@H]([C@@]1([H])N(C[C@]2([H])CC1)C(OC(C)(C)C)=O)N2CC3=C(C=C(C=C3)OC)OC
Tpsa: 51.24
Logp: 3.8421
H Acceptors: 5
H Donors: 0
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:
C₂₂H₃₂N₂O₄
Molecular Weight:
388.50
Synonyms:
None
SMILES:
C=C[C@H]([C@@]1([H])N(C[C@]2([H])CC1)C(OC(C)(C)C)=O)N2CC3=C(C=C(C=C3)OC)OC
Tpsa:
51.24
Logp:
3.8421
H Acceptors:
5
H Donors:
0
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: C₂₂H₃₂N₂O₄
Molecular Weight: 388.50
Synonyms: None
SMILES: C=C[C@@H]([C@@]1([H])N(C[C@]2([H])CC1)C(OC(C)(C)C)=O)N2CC3=C(C=C(C=C3)OC)OC
Tpsa: 51.24
Logp: 3.8421
H Acceptors: 5
H Donors: 0
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:
C₂₂H₃₂N₂O₄
Molecular Weight:
388.50
Synonyms:
None
SMILES:
C=C[C@@H]([C@@]1([H])N(C[C@]2([H])CC1)C(OC(C)(C)C)=O)N2CC3=C(C=C(C=C3)OC)OC
Tpsa:
51.24
Logp:
3.8421
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
5