CS-1004814
Dabigatran Impurity 15
Manufacturer: ChemScene
CAS Number: 771459-37-1
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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
C₂₆H₂₇N₇O₃
Molecular Weight
485.54
Synonyms
None
SMILES
O=C(OC)CCN(C(=O)C=1C=CC2=C(N=C(N2C)CNC3=CC=C(C=C3)C(=N)N)C1)C4=NC=CC=C4
Tpsa
139.22
Logp
3.07437
H Acceptors
8
H Donors
3
Rotatable Bonds
9
SAFETY INFORMATION
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: C₂₆H₂₇N₇O₃
Molecular Weight: 485.54
Synonyms: None
SMILES: O=C(OC)CCN(C(=O)C=1C=CC2=C(N=C(N2C)CNC3=CC=C(C=C3)C(=N)N)C1)C4=NC=CC=C4
Tpsa: 139.22
Logp: 3.07437
H Acceptors: 8
H Donors: 3
Rotatable Bonds: 9
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₆H₂₇N₇O₃
Molecular Weight:
485.54
Synonyms:
None
SMILES:
O=C(OC)CCN(C(=O)C=1C=CC2=C(N=C(N2C)CNC3=CC=C(C=C3)C(=N)N)C1)C4=NC=CC=C4
Tpsa:
139.22
Logp:
3.07437
H Acceptors:
8
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: C₉H₁₃N₃O₅
Molecular Weight: 243.22
Synonyms: None
SMILES: O[C@H]1[C@H](O[C@H](CO)[C@@H]1O)N2C(=O)N=C(N)C=C2
Tpsa: 130.83
Logp: -2.563
H Acceptors: 8
H Donors: 4
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₃N₃O₅
Molecular Weight:
243.22
Synonyms:
None
SMILES:
O[C@H]1[C@H](O[C@H](CO)[C@@H]1O)N2C(=O)N=C(N)C=C2
Tpsa:
130.83
Logp:
-2.563
H Acceptors:
8
H Donors:
4
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₁FN₂O₅
Molecular Weight: 246.19
Synonyms: None
SMILES: O=C1N([C@H]2O[C@H](CO)[C@H](O)C2)C=C(F)C(=O)N1
Tpsa: 104.55
Logp: -1.6836
H Acceptors: 6
H Donors: 3
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₁FN₂O₅
Molecular Weight:
246.19
Synonyms:
None
SMILES:
O=C1N([C@H]2O[C@H](CO)[C@H](O)C2)C=C(F)C(=O)N1
Tpsa:
104.55
Logp:
-1.6836
H Acceptors:
6
H Donors:
3
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₈N₂O₃
Molecular Weight: 202.25
Synonyms: None
SMILES: [C@@H](NC([C@H](CC)N)=O)(C(OC)=O)CC
Tpsa: 81.42
Logp: -0.2085
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:
C₉H₁₈N₂O₃
Molecular Weight:
202.25
Synonyms:
None
SMILES:
[C@@H](NC([C@H](CC)N)=O)(C(OC)=O)CC
Tpsa:
81.42
Logp:
-0.2085
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
5