CS-0802611
Tert-butyl ((R)-4-((2R,5S)-2,5-dimethylpiperazin-1-yl)-4-oxo-1-(2,4,5-trifluorophenyl)butan-2-yl)carbamate
Manufacturer: ChemScene
CAS Number: 1006704-80-8
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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
C₂₁H₃₀F₃N₃O₃
Molecular Weight
429.48
Synonyms
None
SMILES
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1[C@H](C)CN[C@@H](C)C1)CC2=C(F)C=C(F)C(F)=C2
Tpsa
70.67
Logp
3.1386
H Acceptors
4
H Donors
2
Rotatable Bonds
5
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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: C₂₁H₃₀F₃N₃O₃
Molecular Weight: 429.48
Synonyms: None
SMILES: CC(C)(C)OC(=O)N[C@@H](CC(=O)N1[C@H](C)CN[C@@H](C)C1)CC2=C(F)C=C(F)C(F)=C2
Tpsa: 70.67
Logp: 3.1386
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:
C₂₁H₃₀F₃N₃O₃
Molecular Weight:
429.48
Synonyms:
None
SMILES:
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1[C@H](C)CN[C@@H](C)C1)CC2=C(F)C=C(F)C(F)=C2
Tpsa:
70.67
Logp:
3.1386
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: C₁₈H₁₉F₂N₃O₂
Molecular Weight: 347.36
Synonyms: None
SMILES: CCC(=O)NCC(=O)N1[C@@H](C2=C(F)C=C(F)C=C2)C3N(C=CC=3)CC1
Tpsa: 54.34
Logp: 2.2241
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₁₉F₂N₃O₂
Molecular Weight:
347.36
Synonyms:
None
SMILES:
CCC(=O)NCC(=O)N1[C@@H](C2=C(F)C=C(F)C=C2)C3N(C=CC=3)CC1
Tpsa:
54.34
Logp:
2.2241
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₅NO₂S
Molecular Weight: 237.32
Synonyms: None
SMILES: N#CC(C(C)C)S(=O)(=O)C1=CC=C(C)C=C1
Tpsa: 57.93
Logp: 2.3169
H Acceptors: 3
H Donors: 0
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:
C₁₂H₁₅NO₂S
Molecular Weight:
237.32
Synonyms:
None
SMILES:
N#CC(C(C)C)S(=O)(=O)C1=CC=C(C)C=C1
Tpsa:
57.93
Logp:
2.3169
H Acceptors:
3
H Donors:
0
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: C₂₁H₂₄F₄N₄O₃
Molecular Weight: 456.43
Synonyms: None
SMILES: CNC(=O)C1=C(CC2=C(C=C(F)C=C2)C(F)(F)F)N3C(CN(CC3)C(=O)OC(C)(C)C)=N1
Tpsa: 76.46
Logp: 3.7421
H Acceptors: 5
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:
C₂₁H₂₄F₄N₄O₃
Molecular Weight:
456.43
Synonyms:
None
SMILES:
CNC(=O)C1=C(CC2=C(C=C(F)C=C2)C(F)(F)F)N3C(CN(CC3)C(=O)OC(C)(C)C)=N1
Tpsa:
76.46
Logp:
3.7421
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
3