CS-0497720
(6R,7R)-3-(Acetoxymethyl)-7-(2-(((E)-N,N'-diisopropylcarbamimidoyl)thio)acetamido)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylic acid Cefathiamidine Impurity
Manufacturer: ChemScene
CAS Number: 1895899-69-0
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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
C₁₉H₂₈N₄O₆S₂
Molecular Weight
472.58
Synonyms
None
SMILES
O=C([C@@]1([H])NC(CS/C(NC(C)C)=N/C(C)C)=O)N2[C@]1([H])SC=C(COC(C)=O)C2C(O)=O
Tpsa
137.4
Logp
0.7821
H Acceptors
8
H Donors
3
Rotatable Bonds
8
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1895899-69-0 | (6R,7R)-3-(Acetoxymethyl)-7-(2-(((E)-N,N'-diisopropylcarbamimidoyl)thio)acetamido)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylic acid Cefathiamidine Impurity | A2B Chem | -- |
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https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
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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: C₁₉H₂₈N₄O₆S₂
Molecular Weight: 472.58
Synonyms: None
SMILES: O=C([C@@]1([H])NC(CS/C(NC(C)C)=N/C(C)C)=O)N2[C@]1([H])SC=C(COC(C)=O)C2C(O)=O
Tpsa: 137.4
Logp: 0.7821
H Acceptors: 8
H Donors: 3
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:
C₁₉H₂₈N₄O₆S₂
Molecular Weight:
472.58
Synonyms:
None
SMILES:
O=C([C@@]1([H])NC(CS/C(NC(C)C)=N/C(C)C)=O)N2[C@]1([H])SC=C(COC(C)=O)C2C(O)=O
Tpsa:
137.4
Logp:
0.7821
H Acceptors:
8
H Donors:
3
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: C₁₀H₁₂N₂O₆S
Molecular Weight: 288.28
Synonyms: Cefazedone Impurity 14
SMILES: O=C([C@@]1([H])N)N2[C@]1([H])S(CC(COC(C)=O)=C2C(O)=O)=O
Tpsa: 127
Logp: -1.8539
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:
C₁₀H₁₂N₂O₆S
Molecular Weight:
288.28
Synonyms:
Cefazedone Impurity 14
SMILES:
O=C([C@@]1([H])N)N2[C@]1([H])S(CC(COC(C)=O)=C2C(O)=O)=O
Tpsa:
127
Logp:
-1.8539
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
3
Purity: 95%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₇NO₄
Molecular Weight: 227.26
Synonyms: (1S,4S)-4-[(tert-butoxycarbonyl)amino]cyclopent-2-ene-1-carboxylic acid
SMILES: CC(C)(C)OC(N[C@H]1C[C@H](C=C1)C(O)=O)=O
Tpsa: 75.63
Logp: 2.1765
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₇NO₄
Molecular Weight:
227.26
Synonyms:
(1S,4S)-4-[(tert-butoxycarbonyl)amino]cyclopent-2-ene-1-carboxylic acid
SMILES:
CC(C)(C)OC(N[C@H]1C[C@H](C=C1)C(O)=O)=O
Tpsa:
75.63
Logp:
2.1765
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
2
Purity: 97%
MDL No: None
Storage: 4°C, stored under nitrogen
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₆N₂OS
Molecular Weight: 142.18
Synonyms: 5-Methyl-4-thioxo-3,4-dihydro-2(1H)-pyrimidinone
SMILES: O=C1NC(C(C)=CN1)=S
Tpsa: 48.65
Logp: 0.74091
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 0
Purity:
97%
MDL No:
None
Storage:
4°C, stored under nitrogen
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₆N₂OS
Molecular Weight:
142.18
Synonyms:
5-Methyl-4-thioxo-3,4-dihydro-2(1H)-pyrimidinone
SMILES:
O=C1NC(C(C)=CN1)=S
Tpsa:
48.65
Logp:
0.74091
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
0