CS-0914435
4-methoxybenzyl (6R,7R)-3-(chloromethyl)-8-oxo-7-(2-phenylacetamido)-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylate
Manufacturer: ChemScene
CAS Number: 1269661-23-5
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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
C₂₄H₂₃ClN₂O₅S
Molecular Weight
486.97
Synonyms
None
SMILES
C(OCC1=CC=C(OC)C=C1)(=O)C2N3[C@@]([C@H](NC(CC4=CC=CC=C4)=O)C3=O)(SC=C2CCl)[H]
Tpsa
84.94
Logp
2.8723
H Acceptors
6
H Donors
1
Rotatable Bonds
8
Related Products
SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
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: C₂₄H₂₃ClN₂O₅S
Molecular Weight: 486.97
Synonyms: None
SMILES: C(OCC1=CC=C(OC)C=C1)(=O)C2N3[C@@]([C@H](NC(CC4=CC=CC=C4)=O)C3=O)(SC=C2CCl)[H]
Tpsa: 84.94
Logp: 2.8723
H Acceptors: 6
H Donors: 1
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₂₃ClN₂O₅S
Molecular Weight:
486.97
Synonyms:
None
SMILES:
C(OCC1=CC=C(OC)C=C1)(=O)C2N3[C@@]([C@H](NC(CC4=CC=CC=C4)=O)C3=O)(SC=C2CCl)[H]
Tpsa:
84.94
Logp:
2.8723
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
8
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₉BrFNO₃
Molecular Weight: 290.09
Synonyms: None
SMILES: BrC1=C(C=C(F)C=C1)N2C(=O)O[C@@H](CO)C2
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₉BrFNO₃
Molecular Weight:
290.09
Synonyms:
None
SMILES:
BrC1=C(C=C(F)C=C1)N2C(=O)O[C@@H](CO)C2
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₂H₁₉N₃O₅
Molecular Weight: 405.40
Synonyms: None
SMILES: O=C1C2(C(N3[C@](C2)(C(=O)N(C)CC3=O)[H])C=4C=C5C(=CC4)OCO5)C=6C(N1)=CC=CC6
Tpsa: 88.18
Logp: 1.4194
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₂H₁₉N₃O₅
Molecular Weight:
405.40
Synonyms:
None
SMILES:
O=C1C2(C(N3[C@](C2)(C(=O)N(C)CC3=O)[H])C=4C=C5C(=CC4)OCO5)C=6C(N1)=CC=CC6
Tpsa:
88.18
Logp:
1.4194
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
1
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₂H₁₉N₃O₆
Molecular Weight: 421.40
Synonyms: None
SMILES: OC12[C@H](N3[C@]([C@]1(C(=O)C=4C(N2)=CC=CC4)[H])(C(=O)N(C)CC3=O)[H])C=5C=C6C(=CC5)OCO6
Tpsa: 108.41
Logp: 0.7524
H Acceptors: 7
H Donors: 2
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₂H₁₉N₃O₆
Molecular Weight:
421.40
Synonyms:
None
SMILES:
OC12[C@H](N3[C@]([C@]1(C(=O)C=4C(N2)=CC=CC4)[H])(C(=O)N(C)CC3=O)[H])C=5C=C6C(=CC5)OCO6
Tpsa:
108.41
Logp:
0.7524
H Acceptors:
7
H Donors:
2
Rotatable Bonds:
1