CS-0914343
methyl (1R,2S,3R,4R)-3-((S)-1-acetamido-2-ethylbutyl)-4-((tert-butoxycarbonyl)amino)-2-hydroxycyclopentane-1-carboxylate
Manufacturer: ChemScene
CAS Number: 2758048-79-0
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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
C₂₀H₃₆N₂O₆
Molecular Weight
400.51
Synonyms
None
SMILES
[C@@H](C(CC)CC)(NC(C)=O)[C@]1([C@H](NC(OC(C)(C)C)=O)C[C@@H](C(OC)=O)[C@H]1O)[H]
Tpsa
113.96
Logp
1.9906
H Acceptors
6
H Donors
3
Rotatable Bonds
7
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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: C₂₀H₃₆N₂O₆
Molecular Weight: 400.51
Synonyms: None
SMILES: [C@@H](C(CC)CC)(NC(C)=O)[C@]1([C@H](NC(OC(C)(C)C)=O)C[C@@H](C(OC)=O)[C@H]1O)[H]
Tpsa: 113.96
Logp: 1.9906
H Acceptors: 6
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:
C₂₀H₃₆N₂O₆
Molecular Weight:
400.51
Synonyms:
None
SMILES:
[C@@H](C(CC)CC)(NC(C)=O)[C@]1([C@H](NC(OC(C)(C)C)=O)C[C@@H](C(OC)=O)[C@H]1O)[H]
Tpsa:
113.96
Logp:
1.9906
H Acceptors:
6
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: C₁₈H₃₄N₂O₅
Molecular Weight: 358.47
Synonyms: None
SMILES: [C@@H](C(CC)CC)(N)[C@]1([C@H](NC(OC(C)(C)C)=O)C[C@@H](C(OC)=O)[C@H]1O)[H]
Tpsa: 110.88
Logp: 1.8132
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:
C₁₈H₃₄N₂O₅
Molecular Weight:
358.47
Synonyms:
None
SMILES:
[C@@H](C(CC)CC)(N)[C@]1([C@H](NC(OC(C)(C)C)=O)C[C@@H](C(OC)=O)[C@H]1O)[H]
Tpsa:
110.88
Logp:
1.8132
H Acceptors:
6
H Donors:
3
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: C₁₆H₃₀N₄O₄
Molecular Weight: 342.43
Synonyms: None
SMILES: [C@@H](C(CC)CC)(NC(C)=O)[C@]1([C@H](NC(=N)N)C[C@H](C(OC)=O)[C@H]1O)[H]
Tpsa: 137.53
Logp: -0.05103
H Acceptors: 5
H Donors: 5
Rotatable Bonds: 7
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₃₀N₄O₄
Molecular Weight:
342.43
Synonyms:
None
SMILES:
[C@@H](C(CC)CC)(NC(C)=O)[C@]1([C@H](NC(=N)N)C[C@H](C(OC)=O)[C@H]1O)[H]
Tpsa:
137.53
Logp:
-0.05103
H Acceptors:
5
H Donors:
5
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: C₁₃H₂₇ClN₄O₃
Molecular Weight: 322.83
Synonyms: None
SMILES: [C@@H](C(CC)CC)(N)[C@]1([C@H](NC(=N)N)C[C@H](C(O)=O)[C@H]1O)[H].Cl
Tpsa: 145.45
Logp: 0.10497
H Acceptors: 4
H Donors: 6
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:
C₁₃H₂₇ClN₄O₃
Molecular Weight:
322.83
Synonyms:
None
SMILES:
[C@@H](C(CC)CC)(N)[C@]1([C@H](NC(=N)N)C[C@H](C(O)=O)[C@H]1O)[H].Cl
Tpsa:
145.45
Logp:
0.10497
H Acceptors:
4
H Donors:
6
Rotatable Bonds:
6