CS-0914707
Cefetamet Impurity 1
Manufacturer: ChemScene
CAS Number: 1705612-80-1
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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
C₂₁H₂₇N₅O₈S₂
Molecular Weight
541.60
Synonyms
None
SMILES
C(OCOC(C(C)(C)C)=O)(=O)C=1N2[C@@]([C@H](NC(/C(=N\OC)/C=3N=C(NCO)SC3)=O)C2=O)(SCC1C)[H]
Tpsa
168.75
Logp
0.6192
H Acceptors
13
H Donors
3
Rotatable Bonds
9
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: C₂₁H₂₇N₅O₈S₂
Molecular Weight: 541.60
Synonyms: None
SMILES: C(OCOC(C(C)(C)C)=O)(=O)C=1N2[C@@]([C@H](NC(/C(=N\OC)/C=3N=C(NCO)SC3)=O)C2=O)(SCC1C)[H]
Tpsa: 168.75
Logp: 0.6192
H Acceptors: 13
H Donors: 3
Rotatable Bonds: 9
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₁H₂₇N₅O₈S₂
Molecular Weight:
541.60
Synonyms:
None
SMILES:
C(OCOC(C(C)(C)C)=O)(=O)C=1N2[C@@]([C@H](NC(/C(=N\OC)/C=3N=C(NCO)SC3)=O)C2=O)(SCC1C)[H]
Tpsa:
168.75
Logp:
0.6192
H Acceptors:
13
H Donors:
3
Rotatable Bonds:
9
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₁₆N₂O₄S
Molecular Weight: 344.38
Synonyms: None
SMILES: C(O)(=O)C=1N2[C@@]([C@H](NC(CC3=CC=CC=C3)=O)C2=O)(SCC1C=C)[H]
Tpsa: 86.71
Logp: 1.1537
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₁₆N₂O₄S
Molecular Weight:
344.38
Synonyms:
None
SMILES:
C(O)(=O)C=1N2[C@@]([C@H](NC(CC3=CC=CC=C3)=O)C2=O)(SCC1C=C)[H]
Tpsa:
86.71
Logp:
1.1537
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₇N₅O₈S₂
Molecular Weight: 471.46
Synonyms: None
SMILES: O=C(O)C1=NC(SCC1=CC)C(NC(=O)C(=NOCC(=O)O)C=2N=C(SC2)N)C(=O)O
Tpsa: 213.86
Logp: -0.3552
H Acceptors: 11
H Donors: 5
Rotatable Bonds: 9
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₇N₅O₈S₂
Molecular Weight:
471.46
Synonyms:
None
SMILES:
O=C(O)C1=NC(SCC1=CC)C(NC(=O)C(=NOCC(=O)O)C=2N=C(SC2)N)C(=O)O
Tpsa:
213.86
Logp:
-0.3552
H Acceptors:
11
H Donors:
5
Rotatable Bonds:
9
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₅H₂₄N₂O₅S
Molecular Weight: 464.53
Synonyms: None
SMILES: C(OCC1=CC=C(OC)C=C1)(=O)C=2N3[C@@]([C@H](NC(CC4=CC=CC=C4)=O)C3=O)(SCC2C=C)[H]
Tpsa: 84.94
Logp: 2.8211
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:
C₂₅H₂₄N₂O₅S
Molecular Weight:
464.53
Synonyms:
None
SMILES:
C(OCC1=CC=C(OC)C=C1)(=O)C=2N3[C@@]([C@H](NC(CC4=CC=CC=C4)=O)C3=O)(SCC2C=C)[H]
Tpsa:
84.94
Logp:
2.8211
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
8