CS-0141428
tert-Butyl 4-(7-benzyl-2-chloro-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl)piperazine-1-carboxylate
Manufacturer: ChemScene
CAS Number: 2158298-66-7
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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
C₂₃H₃₀ClN₅O₂
Molecular Weight
443.97
Synonyms
1-Piperazinecarboxylic acid, 4-[2-chloro-5,6,7,8-tetrahydro-7-(phenylmethyl)pyrido[3,4-d]pyrimidin-4-yl]-, 1,1-dimethylethyl ester
SMILES
O=C(N1CCN(C2=C3C(CN(CC4=CC=CC=C4)CC3)=NC(Cl)=N2)CC1)OC(C)(C)C
Tpsa
61.8
Logp
3.7454
H Acceptors
6
H Donors
0
Rotatable Bonds
3
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: C₂₃H₃₀ClN₅O₂
Molecular Weight: 443.97
Synonyms: 1-Piperazinecarboxylic acid, 4-[2-chloro-5,6,7,8-tetrahydro-7-(phenylmethyl)pyrido[3,4-d]pyrimidin-4-yl]-, 1,1-dimethylethyl ester
SMILES: O=C(N1CCN(C2=C3C(CN(CC4=CC=CC=C4)CC3)=NC(Cl)=N2)CC1)OC(C)(C)C
Tpsa: 61.8
Logp: 3.7454
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:
C₂₃H₃₀ClN₅O₂
Molecular Weight:
443.97
Synonyms:
1-Piperazinecarboxylic acid, 4-[2-chloro-5,6,7,8-tetrahydro-7-(phenylmethyl)pyrido[3,4-d]pyrimidin-4-yl]-, 1,1-dimethylethyl ester
SMILES:
O=C(N1CCN(C2=C3C(CN(CC4=CC=CC=C4)CC3)=NC(Cl)=N2)CC1)OC(C)(C)C
Tpsa:
61.8
Logp:
3.7454
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
3
Purity: 95+%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₈BrF
Molecular Weight: 203.05
Synonyms: None
SMILES: FC1=CC=C(CC)C(Br)=C1
Tpsa: 0
Logp: 3.1506
H Acceptors: 0
H Donors: 0
Rotatable Bonds: 1
Purity:
95+%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₈BrF
Molecular Weight:
203.05
Synonyms:
None
SMILES:
FC1=CC=C(CC)C(Br)=C1
Tpsa:
0
Logp:
3.1506
H Acceptors:
0
H Donors:
0
Rotatable Bonds:
1
Purity: 95%
MDL No: MFCD16769647
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₃Cl₂NO₂S
Molecular Weight: 236.08
Synonyms: 4-Chloro-2-cyanobenzene-1-sulfonyl chloride
SMILES: O=S(C1=CC=C(Cl)C=C1C#N)(Cl)=O
Tpsa: 57.93
Logp: 2.13918
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 1
Purity:
95%
MDL No:
MFCD16769647
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₃Cl₂NO₂S
Molecular Weight:
236.08
Synonyms:
4-Chloro-2-cyanobenzene-1-sulfonyl chloride
SMILES:
O=S(C1=CC=C(Cl)C=C1C#N)(Cl)=O
Tpsa:
57.93
Logp:
2.13918
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1
Purity: 98%
MDL No: MFCD16620284
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₆Br₂
Molecular Weight: 285.96
Synonyms: 1,6-Dibromonaphthalin
SMILES: BrC1=CC2=CC=CC(Br)=C2C=C1
Tpsa: 0
Logp: 4.3648
H Acceptors: 0
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
MFCD16620284
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₆Br₂
Molecular Weight:
285.96
Synonyms:
1,6-Dibromonaphthalin
SMILES:
BrC1=CC2=CC=CC(Br)=C2C=C1
Tpsa:
0
Logp:
4.3648
H Acceptors:
0
H Donors:
0
Rotatable Bonds:
0