CS-1001679
Tirofiban Impurity 111
Manufacturer: ChemScene
CAS Number: 155727-68-7
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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
C₂₄H₄₀N₂O₅S
Molecular Weight
468.65
Synonyms
None
SMILES
[C@@H](CC1=CC=C(OCCCCC2CCNCC2)C=C1)(NS(CCCC)(=O)=O)C(OCC)=O
Tpsa
93.73
Logp
3.429
H Acceptors
6
H Donors
2
Rotatable Bonds
15
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: C₂₄H₄₀N₂O₅S
Molecular Weight: 468.65
Synonyms: None
SMILES: [C@@H](CC1=CC=C(OCCCCC2CCNCC2)C=C1)(NS(CCCC)(=O)=O)C(OCC)=O
Tpsa: 93.73
Logp: 3.429
H Acceptors: 6
H Donors: 2
Rotatable Bonds: 15
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₄₀N₂O₅S
Molecular Weight:
468.65
Synonyms:
None
SMILES:
[C@@H](CC1=CC=C(OCCCCC2CCNCC2)C=C1)(NS(CCCC)(=O)=O)C(OCC)=O
Tpsa:
93.73
Logp:
3.429
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
15
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₁₅NO
Molecular Weight: 225.29
Synonyms: None
SMILES: O=C(NC=1C=CC=CC1CC=2C=CC=CC2)C
Tpsa: 29.1
Logp: 3.2358
H Acceptors: 1
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:
C₁₅H₁₅NO
Molecular Weight:
225.29
Synonyms:
None
SMILES:
O=C(NC=1C=CC=CC1CC=2C=CC=CC2)C
Tpsa:
29.1
Logp:
3.2358
H Acceptors:
1
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: C₂₂H₂₄ClN₅O₆S
Molecular Weight: 521.97
Synonyms: None
SMILES: C(OCC1=CC=C(N(=O)=O)C=C1)(=O)C=2N3[C@@]([C@@]([C@@H](C)O)(C3=O)[H])([C@@H](C)C2SC4CN5[N+](C4)=CN=C5)[H].[Cl-]
Tpsa: 131.68
Logp: -1.9893
H Acceptors: 9
H Donors: 1
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:
C₂₂H₂₄ClN₅O₆S
Molecular Weight:
521.97
Synonyms:
None
SMILES:
C(OCC1=CC=C(N(=O)=O)C=C1)(=O)C=2N3[C@@]([C@@]([C@@H](C)O)(C3=O)[H])([C@@H](C)C2SC4CN5[N+](C4)=CN=C5)[H].[Cl-]
Tpsa:
131.68
Logp:
-1.9893
H Acceptors:
9
H Donors:
1
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: C₁₅H₁₉NO₃
Molecular Weight: 261.32
Synonyms: None
SMILES: C(N1[C@]2([C@]3([C@@]([C@](C2)(O1)[H])(OC(C)(C)O3)[H])[H])[H])C4=CC=CC=C4
Tpsa: 30.93
Logp: 2.0948
H Acceptors: 4
H Donors: 0
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:
C₁₅H₁₉NO₃
Molecular Weight:
261.32
Synonyms:
None
SMILES:
C(N1[C@]2([C@]3([C@@]([C@](C2)(O1)[H])(OC(C)(C)O3)[H])[H])[H])C4=CC=CC=C4
Tpsa:
30.93
Logp:
2.0948
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
2