CS-1001017
Levosimendan Impurity 25
Manufacturer: ChemScene
CAS Number: 131741-36-1
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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
C₁₄H₁₀N₆O
Molecular Weight
278.27
Synonyms
None
SMILES
N#CC(C#N)=NNC=1C=CC(=CC1)C2=NNC(=O)C=C2C
Tpsa
117.72
Logp
1.56038
H Acceptors
6
H Donors
2
Rotatable Bonds
3
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: C₁₄H₁₀N₆O
Molecular Weight: 278.27
Synonyms: None
SMILES: N#CC(C#N)=NNC=1C=CC(=CC1)C2=NNC(=O)C=C2C
Tpsa: 117.72
Logp: 1.56038
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:
C₁₄H₁₀N₆O
Molecular Weight:
278.27
Synonyms:
None
SMILES:
N#CC(C#N)=NNC=1C=CC(=CC1)C2=NNC(=O)C=C2C
Tpsa:
117.72
Logp:
1.56038
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
3
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₆N₂O₄S
Molecular Weight: 272.32
Synonyms: None
SMILES: O=C(OCC)C1N(C(=O)C2NC(=O)CC2)CSC1
Tpsa: 75.71
Logp: -0.2704
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 3
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₆N₂O₄S
Molecular Weight:
272.32
Synonyms:
None
SMILES:
O=C(OCC)C1N(C(=O)C2NC(=O)CC2)CSC1
Tpsa:
75.71
Logp:
-0.2704
H Acceptors:
5
H Donors:
1
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: C₂₈H₃₆N₄O₂S
Molecular Weight: 492.68
Synonyms: None
SMILES: O=C1[C@@]2([C@@]([C@@]3(C[C@]2(CC3)[H])[H])(C(=O)N1C[C@@H]4[C@H](CN5CCN(CC5)C=6C=7C(SN6)=CC=CC7)CCCC4)[H])[H]
Tpsa: 56.75
Logp: 4.2558
H Acceptors: 6
H Donors: 0
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:
C₂₈H₃₆N₄O₂S
Molecular Weight:
492.68
Synonyms:
None
SMILES:
O=C1[C@@]2([C@@]([C@@]3(C[C@]2(CC3)[H])[H])(C(=O)N1C[C@@H]4[C@H](CN5CCN(CC5)C=6C=7C(SN6)=CC=CC7)CCCC4)[H])[H]
Tpsa:
56.75
Logp:
4.2558
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
5
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₈H₃₆N₄O₂S
Molecular Weight: 492.68
Synonyms: None
SMILES: O=C1[C@]2([C@]([C@@]3(C[C@]2(CC3)[H])[H])(C(=O)N1C[C@H]4[C@@H](CN5CCN(CC5)C=6C=7C(SN6)=CC=CC7)CCCC4)[H])[H]
Tpsa: 56.75
Logp: 4.2558
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 5
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₈H₃₆N₄O₂S
Molecular Weight:
492.68
Synonyms:
None
SMILES:
O=C1[C@]2([C@]([C@@]3(C[C@]2(CC3)[H])[H])(C(=O)N1C[C@H]4[C@@H](CN5CCN(CC5)C=6C=7C(SN6)=CC=CC7)CCCC4)[H])[H]
Tpsa:
56.75
Logp:
4.2558
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
5