CS-0101179
(S)-3-(2-(2-((tert-Butoxycarbonyl)amino)thiazol-4-yl)-2-oxoacetamido)-2,2-dimethyl-4-oxoazetidin-1-yl hydrogen sulfate
Manufacturer: ChemScene
CAS Number: 2101856-15-7
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Purity
98%
MDL No
None
Storage
4°C
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₅H₂₀N₄O₉S₂
Molecular Weight
464.47
Synonyms
Sulfuric acid, mono[(3S)-3-[[2-[2-[[(1,1-dimethylethoxy)carbonyl]amino]-4-thiazolyl]-2-oxoacetyl]amino]-2,2-dimethyl-4-oxo-1-azetidinyl] ester
SMILES
O=S(ON1C(C)(C)[C@H](NC(C(C2=CSC(NC(OC(C)(C)C)=O)=N2)=O)=O)C1=O)(O)=O
Tpsa
181.3
Logp
0.5128
H Acceptors
10
H Donors
3
Rotatable Bonds
6
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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: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₂₀N₄O₉S₂
Molecular Weight: 464.47
Synonyms: Sulfuric acid, mono[(3S)-3-[[2-[2-[[(1,1-dimethylethoxy)carbonyl]amino]-4-thiazolyl]-2-oxoacetyl]amino]-2,2-dimethyl-4-oxo-1-azetidinyl] ester
SMILES: O=S(ON1C(C)(C)[C@H](NC(C(C2=CSC(NC(OC(C)(C)C)=O)=N2)=O)=O)C1=O)(O)=O
Tpsa: 181.3
Logp: 0.5128
H Acceptors: 10
H Donors: 3
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₂₀N₄O₉S₂
Molecular Weight:
464.47
Synonyms:
Sulfuric acid, mono[(3S)-3-[[2-[2-[[(1,1-dimethylethoxy)carbonyl]amino]-4-thiazolyl]-2-oxoacetyl]amino]-2,2-dimethyl-4-oxo-1-azetidinyl] ester
SMILES:
O=S(ON1C(C)(C)[C@H](NC(C(C2=CSC(NC(OC(C)(C)C)=O)=N2)=O)=O)C1=O)(O)=O
Tpsa:
181.3
Logp:
0.5128
H Acceptors:
10
H Donors:
3
Rotatable Bonds:
6
Purity: 95+%
MDL No: MFCD20731728
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₇Cl₃N₂
Molecular Weight: 213.49
Synonyms: None
SMILES: NCC1=CC(Cl)=NC(Cl)=C1.Cl
Tpsa: 38.91
Logp: 2.2689
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 1
Purity:
95+%
MDL No:
MFCD20731728
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₇Cl₃N₂
Molecular Weight:
213.49
Synonyms:
None
SMILES:
NCC1=CC(Cl)=NC(Cl)=C1.Cl
Tpsa:
38.91
Logp:
2.2689
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1
Purity: 96%
MDL No: MFCD30527692
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₃NO₂S
Molecular Weight: 199.27
Synonyms: None
SMILES: CSC1=CN=CC(C(OC)OC)=C1
Tpsa: 31.35
Logp: 2.0949
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 4
Purity:
96%
MDL No:
MFCD30527692
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₃NO₂S
Molecular Weight:
199.27
Synonyms:
None
SMILES:
CSC1=CN=CC(C(OC)OC)=C1
Tpsa:
31.35
Logp:
2.0949
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
4
Purity: 95+%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₈N₂O
Molecular Weight: 148.16
Synonyms: 6-Ethoxypyridine-3-carbonitrile
SMILES: N#CC1=CC=C(OCC)N=C1
Tpsa: 45.91
Logp: 1.35198
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 2
Purity:
95+%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₈N₂O
Molecular Weight:
148.16
Synonyms:
6-Ethoxypyridine-3-carbonitrile
SMILES:
N#CC1=CC=C(OCC)N=C1
Tpsa:
45.91
Logp:
1.35198
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
2