CS-0806716
2-Amino-N-(2-(pyrrolidin-1-yl)ethyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)nicotinamide
Manufacturer: ChemScene
CAS Number: 947249-43-6
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Purity
98%
MDL No
MFCD13190593
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₈H₂₉BN₄O₃
Molecular Weight
360.26
Synonyms
None
SMILES
O=C(C1=CC(B2OC(C)(C)C(C)(C)O2)=CN=C1N)NCCN3CCCC3
Tpsa
89.71
Logp
0.7886
H Acceptors
6
H Donors
2
Rotatable Bonds
5
Related Products
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: MFCD13190593
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₂₉BN₄O₃
Molecular Weight: 360.26
Synonyms: None
SMILES: O=C(C1=CC(B2OC(C)(C)C(C)(C)O2)=CN=C1N)NCCN3CCCC3
Tpsa: 89.71
Logp: 0.7886
H Acceptors: 6
H Donors: 2
Rotatable Bonds: 5
Purity:
98%
MDL No:
MFCD13190593
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₂₉BN₄O₃
Molecular Weight:
360.26
Synonyms:
None
SMILES:
O=C(C1=CC(B2OC(C)(C)C(C)(C)O2)=CN=C1N)NCCN3CCCC3
Tpsa:
89.71
Logp:
0.7886
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
5
Purity: 98%
MDL No: MFCD25513289
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₅F₅N₂O₃
Molecular Weight: 272.13
Synonyms: None
SMILES: FC(F)(F)OC1=CN=C(C)C([N+]([O-])=O)=C1C(F)F
Tpsa: 65.26
Logp: 3.13442
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
MFCD25513289
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₅F₅N₂O₃
Molecular Weight:
272.13
Synonyms:
None
SMILES:
FC(F)(F)OC1=CN=C(C)C([N+]([O-])=O)=C1C(F)F
Tpsa:
65.26
Logp:
3.13442
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
3
Purity: 98%
MDL No: MFCD28696625
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₂ClF₆NO₃
Molecular Weight: 309.55
Synonyms: None
SMILES: C1=C(C(=C(C(=N1)OC(F)(F)F)C(F)(F)F)Cl)C(=O)O
Tpsa: 59.42
Logp: 3.3506
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD28696625
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₂ClF₆NO₃
Molecular Weight:
309.55
Synonyms:
None
SMILES:
C1=C(C(=C(C(=N1)OC(F)(F)F)C(F)(F)F)Cl)C(=O)O
Tpsa:
59.42
Logp:
3.3506
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: MFCD18410795
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₇BrF₃NO₂
Molecular Weight: 346.10
Synonyms: None
SMILES: C1=CC(=C(C=C1C(=O)C2=CC=NC=C2)Br)OC(F)(F)F
Tpsa: 39.19
Logp: 3.9737
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
MFCD18410795
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₇BrF₃NO₂
Molecular Weight:
346.10
Synonyms:
None
SMILES:
C1=CC(=C(C=C1C(=O)C2=CC=NC=C2)Br)OC(F)(F)F
Tpsa:
39.19
Logp:
3.9737
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
3