CS-0137810
tert-Butyl 2-chloro-4-oxo-4,6-dihydrospiro[cyclopenta[d]thiazole-5,4'-piperidine]-1'-carboxylate
Manufacturer: ChemScene
CAS Number: 2245084-91-5
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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
C₁₅H₁₉ClN₂O₃S
Molecular Weight
342.84
Synonyms
Spiro[5H-cyclopentathiazole-5,4'-piperidine]-1'-carboxylic acid, 2-chloro-4,6-dihydro-4-oxo-, 1,1-dimethylethyl ester
SMILES
O=C1C(CCN2C(OC(C)(C)C)=O)(CC2)CC(S3)=C1N=C3Cl
Tpsa
59.5
Logp
3.5526
H Acceptors
5
H Donors
0
Rotatable Bonds
0
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: C₁₅H₁₉ClN₂O₃S
Molecular Weight: 342.84
Synonyms: Spiro[5H-cyclopentathiazole-5,4'-piperidine]-1'-carboxylic acid, 2-chloro-4,6-dihydro-4-oxo-, 1,1-dimethylethyl ester
SMILES: O=C1C(CCN2C(OC(C)(C)C)=O)(CC2)CC(S3)=C1N=C3Cl
Tpsa: 59.5
Logp: 3.5526
H Acceptors: 5
H Donors: 0
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:
C₁₅H₁₉ClN₂O₃S
Molecular Weight:
342.84
Synonyms:
Spiro[5H-cyclopentathiazole-5,4'-piperidine]-1'-carboxylic acid, 2-chloro-4,6-dihydro-4-oxo-, 1,1-dimethylethyl ester
SMILES:
O=C1C(CCN2C(OC(C)(C)C)=O)(CC2)CC(S3)=C1N=C3Cl
Tpsa:
59.5
Logp:
3.5526
H Acceptors:
5
H Donors:
0
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: C₁₁H₂₀F₂N₂O₂
Molecular Weight: 250.29
Synonyms: tert-butyl N-[(3R,5S)-5-(difluoromethyl)-3-piperidyl]carbamate
SMILES: FC(F)[C@H]1C[C@@H](NC(OC(C)(C)C)=O)CNC1
Tpsa: 50.36
Logp: 1.7543
H Acceptors: 3
H Donors: 2
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:
C₁₁H₂₀F₂N₂O₂
Molecular Weight:
250.29
Synonyms:
tert-butyl N-[(3R,5S)-5-(difluoromethyl)-3-piperidyl]carbamate
SMILES:
FC(F)[C@H]1C[C@@H](NC(OC(C)(C)C)=O)CNC1
Tpsa:
50.36
Logp:
1.7543
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
2
Purity: 98%
MDL No: MFCD20486199
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₃Cl₂FN₂O
Molecular Weight: 221.02
Synonyms: 4,6-dichloro-7-fluoro-1H,2H,3H-pyrrolo[3,4-c]pyridin-3-one
SMILES: O=C1NCC2=C1C(Cl)=NC(Cl)=C2F
Tpsa: 41.99
Logp: 1.7709
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
MFCD20486199
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₃Cl₂FN₂O
Molecular Weight:
221.02
Synonyms:
4,6-dichloro-7-fluoro-1H,2H,3H-pyrrolo[3,4-c]pyridin-3-one
SMILES:
O=C1NCC2=C1C(Cl)=NC(Cl)=C2F
Tpsa:
41.99
Logp:
1.7709
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: MFCD15526939
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₅BrN₂O₂
Molecular Weight: 229.03
Synonyms: 6-Bromo-1H-pyrido[2,3-b][1,4]oxazin-2-one
SMILES: O=C1NC2=CC=C(Br)N=C2OC1
Tpsa: 51.22
Logp: 1.175
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
MFCD15526939
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₅BrN₂O₂
Molecular Weight:
229.03
Synonyms:
6-Bromo-1H-pyrido[2,3-b][1,4]oxazin-2-one
SMILES:
O=C1NC2=CC=C(Br)N=C2OC1
Tpsa:
51.22
Logp:
1.175
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
0