CS-0477521
rel-Methyl (2R,3R)-3-[(2-chloro-5-fluoro-4-pyrimidinyl)amino]bicyclo[2.2.2]octane-2-carboxylate
Manufacturer: ChemScene
CAS Number: 1383446-12-5
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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
C₁₄H₁₇ClFN₃O₂
Molecular Weight
313.76
Synonyms
None
SMILES
O=C([C@@H]1C(CC2)CCC2[C@H]1NC3=NC(Cl)=NC=C3F)OC
Tpsa
64.11
Logp
2.6588
H Acceptors
5
H Donors
1
Rotatable Bonds
3
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1383446-12-5 | rel-Methyl (2R,3R)-3-[(2-chloro-5-fluoro-4-pyrimidinyl)amino]bicyclo[2.2.2]octane-2-carboxylate | A2B Chem | -- |
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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: C₁₄H₁₇ClFN₃O₂
Molecular Weight: 313.76
Synonyms: None
SMILES: O=C([C@@H]1C(CC2)CCC2[C@H]1NC3=NC(Cl)=NC=C3F)OC
Tpsa: 64.11
Logp: 2.6588
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:
C₁₄H₁₇ClFN₃O₂
Molecular Weight:
313.76
Synonyms:
None
SMILES:
O=C([C@@H]1C(CC2)CCC2[C@H]1NC3=NC(Cl)=NC=C3F)OC
Tpsa:
64.11
Logp:
2.6588
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: C₁₁H₁₄ClN₃OS
Molecular Weight: 271.77
Synonyms: (2-chloro-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl)-(tetrahydropyran-4-yl)-amine
SMILES: ClC1=NC(NC2CCOCC2)=C2SCCC2=N1
Tpsa: 47.04
Logp: 2.3691
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₄ClN₃OS
Molecular Weight:
271.77
Synonyms:
(2-chloro-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl)-(tetrahydropyran-4-yl)-amine
SMILES:
ClC1=NC(NC2CCOCC2)=C2SCCC2=N1
Tpsa:
47.04
Logp:
2.3691
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₄ClN₃O₂S
Molecular Weight: 287.77
Synonyms: None
SMILES: ClC1=NC(NC2CCOCC2)=C2C(CC[S@]2=O)=N1
Tpsa: 64.11
Logp: 1.3846
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₄ClN₃O₂S
Molecular Weight:
287.77
Synonyms:
None
SMILES:
ClC1=NC(NC2CCOCC2)=C2C(CC[S@]2=O)=N1
Tpsa:
64.11
Logp:
1.3846
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₂FNO
Molecular Weight: 181.21
Synonyms: None
SMILES: NC1=C(C2CCCO2)C(F)=CC=C1
Tpsa: 35.25
Logp: 2.2594
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₂FNO
Molecular Weight:
181.21
Synonyms:
None
SMILES:
NC1=C(C2CCCO2)C(F)=CC=C1
Tpsa:
35.25
Logp:
2.2594
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1