CS-0159437
Ethyl (S)-6-(bromomethyl)-4-(3-fluoro-2-methylphenyl)-2-(thiazol-2-yl)-1,4-dihydropyrimidine-5-carboxylate
Manufacturer: ChemScene
CAS Number: 1808249-63-9
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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
C₁₈H₁₇BrFN₃O₂S
Molecular Weight
438.31
Synonyms
None
SMILES
CCOC(C1=C(NC(C2=NC=CS2)=N[C@H]1C3=CC=CC(F)=C3C)CBr)=O
Tpsa
63.58
Logp
3.89382
H Acceptors
6
H Donors
1
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: C₁₈H₁₇BrFN₃O₂S
Molecular Weight: 438.31
Synonyms: None
SMILES: CCOC(C1=C(NC(C2=NC=CS2)=N[C@H]1C3=CC=CC(F)=C3C)CBr)=O
Tpsa: 63.58
Logp: 3.89382
H Acceptors: 6
H Donors: 1
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:
C₁₈H₁₇BrFN₃O₂S
Molecular Weight:
438.31
Synonyms:
None
SMILES:
CCOC(C1=C(NC(C2=NC=CS2)=N[C@H]1C3=CC=CC(F)=C3C)CBr)=O
Tpsa:
63.58
Logp:
3.89382
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
5
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₇ClF₂N₂O₂
Molecular Weight: 270.70
Synonyms: None
SMILES: O=C(N1CC(F)(F)C12CNC2)OC(C)(C)C.[H]Cl
Tpsa: 41.57
Logp: 1.6362
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 0
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₇ClF₂N₂O₂
Molecular Weight:
270.70
Synonyms:
None
SMILES:
O=C(N1CC(F)(F)C12CNC2)OC(C)(C)C.[H]Cl
Tpsa:
41.57
Logp:
1.6362
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
0
Purity: 97%
MDL No: MFCD29042820
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₈N₂O₄S
Molecular Weight: 298.36
Synonyms: 2,6-Diaza-spiro[3.4]octan-7-one toluene-4-sulfonic acid salt
SMILES: O=S(C1=CC=C(C)C=C1)(O)=O.O=C(C2)NCC32CNC3
Tpsa: 95.5
Logp: 0.33762
H Acceptors: 4
H Donors: 3
Rotatable Bonds: 1
Purity:
97%
MDL No:
MFCD29042820
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₈N₂O₄S
Molecular Weight:
298.36
Synonyms:
2,6-Diaza-spiro[3.4]octan-7-one toluene-4-sulfonic acid salt
SMILES:
O=S(C1=CC=C(C)C=C1)(O)=O.O=C(C2)NCC32CNC3
Tpsa:
95.5
Logp:
0.33762
H Acceptors:
4
H Donors:
3
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: C₁₂H₂₀F₂N₂O₂
Molecular Weight: 262.30
Synonyms: None
SMILES: O=C(N1CCC2C(NCC2(F)F)C1)OC(C)(C)C
Tpsa: 41.57
Logp: 1.8505
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₂₀F₂N₂O₂
Molecular Weight:
262.30
Synonyms:
None
SMILES:
O=C(N1CCC2C(NCC2(F)F)C1)OC(C)(C)C
Tpsa:
41.57
Logp:
1.8505
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
0