CS-0900620
tert-Butyl 4-(4-amino-5-((2,3-dichlorophenyl)thio)-1-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)piperazine-1-carboxylate
Manufacturer: ChemScene
CAS Number: 2694870-26-1
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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
C₂₀H₂₅Cl₂N₅O₃S
Molecular Weight
486.42
Synonyms
None
SMILES
O=C(N1CCN(CC1)C2=NC(N)=C(C(N2C)=O)SC3=C(Cl)C(Cl)=CC=C3)OC(C)(C)C
Tpsa
93.69
Logp
3.8776
H Acceptors
8
H Donors
1
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: C₂₀H₂₅Cl₂N₅O₃S
Molecular Weight: 486.42
Synonyms: None
SMILES: O=C(N1CCN(CC1)C2=NC(N)=C(C(N2C)=O)SC3=C(Cl)C(Cl)=CC=C3)OC(C)(C)C
Tpsa: 93.69
Logp: 3.8776
H Acceptors: 8
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:
C₂₀H₂₅Cl₂N₅O₃S
Molecular Weight:
486.42
Synonyms:
None
SMILES:
O=C(N1CCN(CC1)C2=NC(N)=C(C(N2C)=O)SC3=C(Cl)C(Cl)=CC=C3)OC(C)(C)C
Tpsa:
93.69
Logp:
3.8776
H Acceptors:
8
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: C₁₄H₁₅Cl₂N₅
Molecular Weight: 324.21
Synonyms: None
SMILES: ClC1=CC=CC(C2=NC=C(N3CCNCC3)N=C2N)=C1Cl
Tpsa: 67.07
Logp: 2.4422
H Acceptors: 5
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:
C₁₄H₁₅Cl₂N₅
Molecular Weight:
324.21
Synonyms:
None
SMILES:
ClC1=CC=CC(C2=NC=C(N3CCNCC3)N=C2N)=C1Cl
Tpsa:
67.07
Logp:
2.4422
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
2
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₅ClN₂O
Molecular Weight: 144.56
Synonyms: None
SMILES: O=C1C=C(N)C(Cl)=CN1
Tpsa: 58.88
Logp: 0.6105
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 0
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₅ClN₂O
Molecular Weight:
144.56
Synonyms:
None
SMILES:
O=C1C=C(N)C(Cl)=CN1
Tpsa:
58.88
Logp:
0.6105
H Acceptors:
2
H Donors:
2
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: C₂₂H₃₅N₃O₂
Molecular Weight: 373.53
Synonyms: None
SMILES: CC(C)(C)OC(N[C@@H]1[C@H](CCCC1)N2CCN(CC3=CC=CC=C3)CC2)=O
Tpsa: 44.81
Logp: 3.6401
H Acceptors: 4
H Donors: 1
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:
C₂₂H₃₅N₃O₂
Molecular Weight:
373.53
Synonyms:
None
SMILES:
CC(C)(C)OC(N[C@@H]1[C@H](CCCC1)N2CCN(CC3=CC=CC=C3)CC2)=O
Tpsa:
44.81
Logp:
3.6401
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
4