CS-0858138
(6R,7R)-7-Amino-3-((4-carbamoylpyridin-1-ium-1-yl)methyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
Manufacturer: ChemScene
CAS Number: 60903-42-6
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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
C₁₄H₁₄N₄O₄S
Molecular Weight
334.35
Synonyms
None
SMILES
[O-]C(C(N1[C@@]2([H])[C@H](N)C1=O)=C(CS2)C[N+]3=CC=C(C(N)=O)C=C3)=O
Tpsa
133.43
Logp
-2.6806
H Acceptors
6
H Donors
2
Rotatable Bonds
4
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: C₁₄H₁₄N₄O₄S
Molecular Weight: 334.35
Synonyms: None
SMILES: [O-]C(C(N1[C@@]2([H])[C@H](N)C1=O)=C(CS2)C[N+]3=CC=C(C(N)=O)C=C3)=O
Tpsa: 133.43
Logp: -2.6806
H Acceptors: 6
H Donors: 2
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:
C₁₄H₁₄N₄O₄S
Molecular Weight:
334.35
Synonyms:
None
SMILES:
[O-]C(C(N1[C@@]2([H])[C@H](N)C1=O)=C(CS2)C[N+]3=CC=C(C(N)=O)C=C3)=O
Tpsa:
133.43
Logp:
-2.6806
H Acceptors:
6
H Donors:
2
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: C₁₁H₁₉NO₃
Molecular Weight: 213.27
Synonyms: None
SMILES: CC[C@@H](C(O)=O)N1C[C@@H](CCC)CC1=O
Tpsa: 57.61
Logp: 1.4982
H Acceptors: 2
H Donors: 1
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:
C₁₁H₁₉NO₃
Molecular Weight:
213.27
Synonyms:
None
SMILES:
CC[C@@H](C(O)=O)N1C[C@@H](CCC)CC1=O
Tpsa:
57.61
Logp:
1.4982
H Acceptors:
2
H Donors:
1
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: C₂₃H₃₂F₃N₅O₄
Molecular Weight: 499.53
Synonyms: None
SMILES: O=C(N[C@H](C[C@@H]1CCNC1=O)C#N)[C@H]2N(C([C@@H](NC(C(F)(F)F)=O)C(C)(C)C)=O)C[C@H]3[C@@H]2C3(C)C
Tpsa: 131.4
Logp: 1.09718
H Acceptors: 5
H Donors: 3
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₃H₃₂F₃N₅O₄
Molecular Weight:
499.53
Synonyms:
None
SMILES:
O=C(N[C@H](C[C@@H]1CCNC1=O)C#N)[C@H]2N(C([C@@H](NC(C(F)(F)F)=O)C(C)(C)C)=O)C[C@H]3[C@@H]2C3(C)C
Tpsa:
131.4
Logp:
1.09718
H Acceptors:
5
H Donors:
3
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₆H₂₆N₂O₃
Molecular Weight: 414.50
Synonyms: None
SMILES: O=C(C1=C(C)C=CC=C1)NC2=CC=C(C(C)=C2)C(N3C4=C(C(CCC3)O)C=CC=C4)=O
Tpsa: 69.64
Logp: 5.02974
H Acceptors: 3
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:
C₂₆H₂₆N₂O₃
Molecular Weight:
414.50
Synonyms:
None
SMILES:
O=C(C1=C(C)C=CC=C1)NC2=CC=C(C(C)=C2)C(N3C4=C(C(CCC3)O)C=CC=C4)=O
Tpsa:
69.64
Logp:
5.02974
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
3