CS-0063595
AFN-1252 (tosylate)
Manufacturer: ChemScene
CAS Number: 1047981-31-6
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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
C₂₉H₂₉N₃O₆S
Molecular Weight
547.62
Synonyms
API-1252 (tosylate); Debio 1452 (tosylate)
SMILES
O=S(O)(C1=CC=C(C=C1)C)=O.CC2=C(CN(C)C(/C=C/C(C=C3CC4)=CNC3=NC4=O)=O)OC5=CC=CC=C25
Tpsa
N/A
Logp
N/A
H Acceptors
N/A
H Donors
N/A
Rotatable Bonds
N/A
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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: C₂₉H₂₉N₃O₆S
Molecular Weight: 547.62
Synonyms: API-1252 (tosylate); Debio 1452 (tosylate)
SMILES: O=S(O)(C1=CC=C(C=C1)C)=O.CC2=C(CN(C)C(/C=C/C(C=C3CC4)=CNC3=NC4=O)=O)OC5=CC=CC=C25
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₉H₂₉N₃O₆S
Molecular Weight:
547.62
Synonyms:
API-1252 (tosylate); Debio 1452 (tosylate)
SMILES:
O=S(O)(C1=CC=C(C=C1)C)=O.CC2=C(CN(C)C(/C=C/C(C=C3CC4)=CNC3=NC4=O)=O)OC5=CC=CC=C25
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A
Purity: 98%
MDL No: MFCD28334511
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₁H₅₆O₁₅S
Molecular Weight: 700.83
Synonyms: None
SMILES: OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOS(C1=CC=C(C)C=C1)(=O)=O
Tpsa: 165.13
Logp: 0.87522
H Acceptors: 15
H Donors: 1
Rotatable Bonds: 37
Purity:
98%
MDL No:
MFCD28334511
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₁H₅₆O₁₅S
Molecular Weight:
700.83
Synonyms:
None
SMILES:
OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOS(C1=CC=C(C)C=C1)(=O)=O
Tpsa:
165.13
Logp:
0.87522
H Acceptors:
15
H Donors:
1
Rotatable Bonds:
37
Purity: 98%
MDL No: None
Storage: 4°C, sealed storage, away from moisture
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₄F₂O₃
Molecular Weight: 186.11
Synonyms: None
SMILES: FC1=C(F)C=CC2=C1C(O)OC2=O
Tpsa: 46.53
Logp: 1.1261
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
4°C, sealed storage, away from moisture
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₄F₂O₃
Molecular Weight:
186.11
Synonyms:
None
SMILES:
FC1=C(F)C=CC2=C1C(O)OC2=O
Tpsa:
46.53
Logp:
1.1261
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: MFCD00002578
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃H₂O₅
Molecular Weight: 118.04
Synonyms: Ketomalonic acid; Mesoxalic acid; Oxomalonic acid
SMILES: O=C(C(C(O)=O)=O)O
Tpsa: 91.67
Logp: -1.2753
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD00002578
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃H₂O₅
Molecular Weight:
118.04
Synonyms:
Ketomalonic acid; Mesoxalic acid; Oxomalonic acid
SMILES:
O=C(C(C(O)=O)=O)O
Tpsa:
91.67
Logp:
-1.2753
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
2