CS-0649488
(3R,4S)-Benzyl 3-(2-((ethoxycarbonyl)(5-tosyl-5H-pyrrolo[2,3-b]pyrazin-2-yl)amino)acetyl)-4-ethylpyrrolidine-1-carboxylate
Manufacturer: ChemScene
CAS Number: 2050038-81-6
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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
C₃₂H₃₅N₅O₇S
Molecular Weight
633.72
Synonyms
None
SMILES
O=S(N1C2=NC=C(N(C(OCC)=O)CC([C@@H]3[C@@H](CN(C3)C(OCC4=CC=CC=C4)=O)CC)=O)N=C2C=C1)(C5=CC=C(C=C5)C)=O
Tpsa
N/A
Logp
N/A
H Acceptors
N/A
H Donors
N/A
Rotatable Bonds
N/A
Other Options
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-P304+P340-P305+P351+P338-P330-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: C₃₂H₃₅N₅O₇S
Molecular Weight: 633.72
Synonyms: None
SMILES: O=S(N1C2=NC=C(N(C(OCC)=O)CC([C@@H]3[C@@H](CN(C3)C(OCC4=CC=CC=C4)=O)CC)=O)N=C2C=C1)(C5=CC=C(C=C5)C)=O
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:
C₃₂H₃₅N₅O₇S
Molecular Weight:
633.72
Synonyms:
None
SMILES:
O=S(N1C2=NC=C(N(C(OCC)=O)CC([C@@H]3[C@@H](CN(C3)C(OCC4=CC=CC=C4)=O)CC)=O)N=C2C=C1)(C5=CC=C(C=C5)C)=O
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: C₁₁H₂₁NO₄
Molecular Weight: 231.29
Synonyms: None
SMILES: O=C(NCC(C1COCC1)O)OC(C)(C)C
Tpsa: 67.79
Logp: 0.9085
H Acceptors: 4
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:
C₁₁H₂₁NO₄
Molecular Weight:
231.29
Synonyms:
None
SMILES:
O=C(NCC(C1COCC1)O)OC(C)(C)C
Tpsa:
67.79
Logp:
0.9085
H Acceptors:
4
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: C₁₄H₂₀BNO₅
Molecular Weight: 293.12
Synonyms: None
SMILES: O=C(C1=NC(OC)=CC(B2OC(C)(C)C(C)(C)O2)=C1)OC
Tpsa: 66.88
Logp: 1.176
H Acceptors: 6
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:
C₁₄H₂₀BNO₅
Molecular Weight:
293.12
Synonyms:
None
SMILES:
O=C(C1=NC(OC)=CC(B2OC(C)(C)C(C)(C)O2)=C1)OC
Tpsa:
66.88
Logp:
1.176
H Acceptors:
6
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: C₁₅H₁₂BrF₃O₂
Molecular Weight: 361.15
Synonyms: None
SMILES: FC(C1=CC=C(Br)C(OCC2=CC=C(OC)C=C2)=C1)(F)F
Tpsa: 18.46
Logp: 5.0555
H Acceptors: 2
H Donors: 0
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:
C₁₅H₁₂BrF₃O₂
Molecular Weight:
361.15
Synonyms:
None
SMILES:
FC(C1=CC=C(Br)C(OCC2=CC=C(OC)C=C2)=C1)(F)F
Tpsa:
18.46
Logp:
5.0555
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
4