CS-0913986
(2S,3S)-3-amino-2-((Z)-2-(2-aminothiazol-4-yl)-2-(((2-carboxypropan- 2-yl)oxy)imino)acetamido)butanoicacid compound with 2,2,2- trifluoroacetic acid
Manufacturer: ChemScene
CAS Number: 102586-36-7
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Purity
95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₃H₁₉N₅O₆S
Molecular Weight
373.38
Synonyms
None
SMILES
C(\C(N[C@@H]([C@H](C)N)C(O)=O)=O)(=N\OC(C(O)=O)(C)C)/C1=CSC(N)=N1
Tpsa
190.22
Logp
-0.7742
H Acceptors
9
H Donors
5
Rotatable Bonds
8
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | Aztreonam Impurity B | Aaron Chemicals LLC | -- |
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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: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₉N₅O₆S
Molecular Weight: 373.38
Synonyms: None
SMILES: C(\C(N[C@@H]([C@H](C)N)C(O)=O)=O)(=N\OC(C(O)=O)(C)C)/C1=CSC(N)=N1
Tpsa: 190.22
Logp: -0.7742
H Acceptors: 9
H Donors: 5
Rotatable Bonds: 8
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₉N₅O₆S
Molecular Weight:
373.38
Synonyms:
None
SMILES:
C(\C(N[C@@H]([C@H](C)N)C(O)=O)=O)(=N\OC(C(O)=O)(C)C)/C1=CSC(N)=N1
Tpsa:
190.22
Logp:
-0.7742
H Acceptors:
9
H Donors:
5
Rotatable Bonds:
8
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₇N₅O₅S
Molecular Weight: 355.37
Synonyms: None
SMILES: C(\C(N[C@H]1[C@H](C)NC1=O)=O)(=N\OC(C(O)=O)(C)C)/C2=CSC(N)=N2
Tpsa: 156
Logp: -0.6877
H Acceptors: 8
H Donors: 4
Rotatable Bonds: 6
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₇N₅O₅S
Molecular Weight:
355.37
Synonyms:
None
SMILES:
C(\C(N[C@H]1[C@H](C)NC1=O)=O)(=N\OC(C(O)=O)(C)C)/C2=CSC(N)=N2
Tpsa:
156
Logp:
-0.6877
H Acceptors:
8
H Donors:
4
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: C₁₇H₂₅N₅O₈S₂
Molecular Weight: 491.54
Synonyms: None
SMILES: N(C(/C(=N\OC(C(OC(C)(C)C)=O)(C)C)/C1=CSC(N)=N1)=O)[C@H]2[C@H](C)N(S(=O)(=O)O)C2=O
Tpsa: 190.58
Logp: 0.0846
H Acceptors: 11
H Donors: 3
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₂₅N₅O₈S₂
Molecular Weight:
491.54
Synonyms:
None
SMILES:
N(C(/C(=N\OC(C(OC(C)(C)C)=O)(C)C)/C1=CSC(N)=N1)=O)[C@H]2[C@H](C)N(S(=O)(=O)O)C2=O
Tpsa:
190.58
Logp:
0.0846
H Acceptors:
11
H Donors:
3
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₇H₆₉ClN₂O₁₃
Molecular Weight: 785.40
Synonyms: None
SMILES: O([C@H]1[C@H](C)[C@@H](O[C@H]2[C@H](O)[C@@H](N(C)C)C[C@@H](C)O2)[C@](C)(O)C[C@@H](C)C(=NO)[C@H](C)[C@@H](O)[C@](C)(O)[C@@H](CC)OC(=O)[C@@H]1C)[C@H]3C[C@](OC)(C)[C@@H](O)[C@H](C)O3.Cl
Tpsa: 209.43
Logp: 2.4685
H Acceptors: 15
H Donors: 6
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₇H₆₉ClN₂O₁₃
Molecular Weight:
785.40
Synonyms:
None
SMILES:
O([C@H]1[C@H](C)[C@@H](O[C@H]2[C@H](O)[C@@H](N(C)C)C[C@@H](C)O2)[C@](C)(O)C[C@@H](C)C(=NO)[C@H](C)[C@@H](O)[C@](C)(O)[C@@H](CC)OC(=O)[C@@H]1C)[C@H]3C[C@](OC)(C)[C@@H](O)[C@H](C)O3.Cl
Tpsa:
209.43
Logp:
2.4685
H Acceptors:
15
H Donors:
6
Rotatable Bonds:
7