CS-0119601
Benzofuro[3,2-d]pyrimidin-4-yl-L-alanine
Manufacturer: ChemScene
CAS Number: 499104-82-4
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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
C₁₃H₁₁N₃O₃
Molecular Weight
257.24
Synonyms
2-(BENZO[4,5]FURO[3,2-D]PYRIMIDIN-4-YLAMINO)-PROPIONIC ACID
SMILES
C[C@@H](C(O)=O)NC1=C(OC2=CC=CC=C23)C3=NC=N1
Tpsa
88.25
Logp
2.261
H Acceptors
5
H Donors
2
Rotatable Bonds
3
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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₁N₃O₃
Molecular Weight: 257.24
Synonyms: 2-(BENZO[4,5]FURO[3,2-D]PYRIMIDIN-4-YLAMINO)-PROPIONIC ACID
SMILES: C[C@@H](C(O)=O)NC1=C(OC2=CC=CC=C23)C3=NC=N1
Tpsa: 88.25
Logp: 2.261
H Acceptors: 5
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:
C₁₃H₁₁N₃O₃
Molecular Weight:
257.24
Synonyms:
2-(BENZO[4,5]FURO[3,2-D]PYRIMIDIN-4-YLAMINO)-PROPIONIC ACID
SMILES:
C[C@@H](C(O)=O)NC1=C(OC2=CC=CC=C23)C3=NC=N1
Tpsa:
88.25
Logp:
2.261
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
3
Purity: 97%
MDL No: MFCD02634635
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₂N₂O₃
Molecular Weight: 232.24
Synonyms: 5-Benzoimidazol-1-yl-5-oxo-pentanoic acid
SMILES: OC(CCCC(N1C(C=CC=C2)=C2N=C1)=O)=O
Tpsa: 72.19
Logp: 1.9314
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 4
Purity:
97%
MDL No:
MFCD02634635
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₂N₂O₃
Molecular Weight:
232.24
Synonyms:
5-Benzoimidazol-1-yl-5-oxo-pentanoic acid
SMILES:
OC(CCCC(N1C(C=CC=C2)=C2N=C1)=O)=O
Tpsa:
72.19
Logp:
1.9314
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
4
Purity: 97%
MDL No: MFCD00037916
Storage: -20°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₇NO₄
Molecular Weight: 157.12
Synonyms: Succinimidyl acetate
SMILES: O=C(CC1)N(OC(C)=O)C1=O
Tpsa: 63.68
Logp: -0.3865
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 1
Purity:
97%
MDL No:
MFCD00037916
Storage:
-20°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₇NO₄
Molecular Weight:
157.12
Synonyms:
Succinimidyl acetate
SMILES:
O=C(CC1)N(OC(C)=O)C1=O
Tpsa:
63.68
Logp:
-0.3865
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
1
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₄H₂₄N₆O₂
Molecular Weight: 428.49
Synonyms: Ibrutinib iMpurity YX
SMILES: CC(N1C[C@H](N2N=C(C3=CC=C(OC4=CC=CC=C4)C=C3)C5=C(N)N=CN=C52)CCC1)=O
Tpsa: 99.16
Logp: 4.0512
H Acceptors: 7
H Donors: 1
Rotatable Bonds: 4
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₂₄N₆O₂
Molecular Weight:
428.49
Synonyms:
Ibrutinib iMpurity YX
SMILES:
CC(N1C[C@H](N2N=C(C3=CC=C(OC4=CC=CC=C4)C=C3)C5=C(N)N=CN=C52)CCC1)=O
Tpsa:
99.16
Logp:
4.0512
H Acceptors:
7
H Donors:
1
Rotatable Bonds:
4