CS-0498105
(2S,5R,6R)-3,3-Dimethyl-6-(2-(3-(methylsulfonyl)-2-oxoimidazolidine-1-carboxamido)-2-phenylacetamido)-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 4-oxide Mezlocillin Impurity
Manufacturer: ChemScene
CAS Number: None
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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
C₂₁H₂₅N₅O₉S₂
Molecular Weight
555.58
Synonyms
None
SMILES
CS(N(C1=O)CCN1C(NC(C2=CC=CC=C2)(C(N[C@]([C@]3([H])N4[C@@]([H])(C(O)=O)C(C)(C)S3=O)([H])C4=O)=O)[H])=O)(=O)=O
Tpsa
190.57
Logp
-1.2183
H Acceptors
8
H Donors
3
Rotatable Bonds
6
Other Options
...
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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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₁H₂₅N₅O₉S₂
Molecular Weight: 555.58
Synonyms: None
SMILES: CS(N(C1=O)CCN1C(NC(C2=CC=CC=C2)(C(N[C@]([C@]3([H])N4[C@@]([H])(C(O)=O)C(C)(C)S3=O)([H])C4=O)=O)[H])=O)(=O)=O
Tpsa: 190.57
Logp: -1.2183
H Acceptors: 8
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:
C₂₁H₂₅N₅O₉S₂
Molecular Weight:
555.58
Synonyms:
None
SMILES:
CS(N(C1=O)CCN1C(NC(C2=CC=CC=C2)(C(N[C@]([C@]3([H])N4[C@@]([H])(C(O)=O)C(C)(C)S3=O)([H])C4=O)=O)[H])=O)(=O)=O
Tpsa:
190.57
Logp:
-1.2183
H Acceptors:
8
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: C₂₁H₂₅N₅O₁₀S₂
Molecular Weight: 571.58
Synonyms: None
SMILES: CS(N(C1=O)CCN1C(NC(C2=CC=CC=C2)(C(N[C@]([C@]3([H])N4[C@@]([H])(C(O)=O)C(C)(C)S3(=O)=O)([H])C4=O)=O)[H])=O)(=O)=O
Tpsa: 207.64
Logp: -1.5522
H Acceptors: 9
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:
C₂₁H₂₅N₅O₁₀S₂
Molecular Weight:
571.58
Synonyms:
None
SMILES:
CS(N(C1=O)CCN1C(NC(C2=CC=CC=C2)(C(N[C@]([C@]3([H])N4[C@@]([H])(C(O)=O)C(C)(C)S3(=O)=O)([H])C4=O)=O)[H])=O)(=O)=O
Tpsa:
207.64
Logp:
-1.5522
H Acceptors:
9
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: C₃₄H₄₄N₈O₁₁S₃
Molecular Weight: 836.96
Synonyms: None
SMILES: CS(N(C1=O)CCN1C(N[C@](C(N[C@]2([H])C(N3[C@]2([H])SC(C)(C)[C@@]3(C(N[C@](C4=CC=CC=C4)(C(N[C@]5([H])C(N6[C@]5([H])SC(C)(C)[C@]6([H])C(OCC)=O)=O)=O)[H])=O)[H])=O)=O)([H])C)=O)(=O)=O
Tpsa: 241.01
Logp: -0.7035
H Acceptors: 13
H Donors: 4
Rotatable Bonds: 11
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₄H₄₄N₈O₁₁S₃
Molecular Weight:
836.96
Synonyms:
None
SMILES:
CS(N(C1=O)CCN1C(N[C@](C(N[C@]2([H])C(N3[C@]2([H])SC(C)(C)[C@@]3(C(N[C@](C4=CC=CC=C4)(C(N[C@]5([H])C(N6[C@]5([H])SC(C)(C)[C@]6([H])C(OCC)=O)=O)=O)[H])=O)[H])=O)=O)([H])C)=O)(=O)=O
Tpsa:
241.01
Logp:
-0.7035
H Acceptors:
13
H Donors:
4
Rotatable Bonds:
11
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₁₈N₄O₇S
Molecular Weight: 398.39
Synonyms: None
SMILES: OC(CNC(C(NC(N1C(N(S(C)(=O)=O)CC1)=O)=O)C2=CC=CC=C2)=O)=O
Tpsa: 153.19
Logp: -0.6647
H Acceptors: 6
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:
C₁₅H₁₈N₄O₇S
Molecular Weight:
398.39
Synonyms:
None
SMILES:
OC(CNC(C(NC(N1C(N(S(C)(=O)=O)CC1)=O)=O)C2=CC=CC=C2)=O)=O
Tpsa:
153.19
Logp:
-0.6647
H Acceptors:
6
H Donors:
3
Rotatable Bonds:
6