CS-0729506
7-Amino-1,3,4,5-tetrahydro-5-(2-nitrophenyl)-2,4-dioxo-2H-pyrano[2,3-d]pyrimidine-6-carbonitrile
Manufacturer: ChemScene
CAS Number: 94988-65-5
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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
C₁₄H₉N₅O₅
Molecular Weight
327.25
Synonyms
None
SMILES
N#CC(C1C2=CC=CC=C2[N+]([O-])=O)=C(N)OC(NC3=O)=C1C(N3)=O
Tpsa
167.9
Logp
0.18958
H Acceptors
7
H Donors
3
Rotatable Bonds
2
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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: C₁₄H₉N₅O₅
Molecular Weight: 327.25
Synonyms: None
SMILES: N#CC(C1C2=CC=CC=C2[N+]([O-])=O)=C(N)OC(NC3=O)=C1C(N3)=O
Tpsa: 167.9
Logp: 0.18958
H Acceptors: 7
H Donors: 3
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:
C₁₄H₉N₅O₅
Molecular Weight:
327.25
Synonyms:
None
SMILES:
N#CC(C1C2=CC=CC=C2[N+]([O-])=O)=C(N)OC(NC3=O)=C1C(N3)=O
Tpsa:
167.9
Logp:
0.18958
H Acceptors:
7
H Donors:
3
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: C₂₀H₂₂N₂O₄
Molecular Weight: 354.40
Synonyms: None
SMILES: N#CC1=C(N)OC2=C(C1C3=CC=C(C(OCC)=C3)OCC)C(CCC2)=O
Tpsa: 94.57
Logp: 3.29878
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:
C₂₀H₂₂N₂O₄
Molecular Weight:
354.40
Synonyms:
None
SMILES:
N#CC1=C(N)OC2=C(C1C3=CC=C(C(OCC)=C3)OCC)C(CCC2)=O
Tpsa:
94.57
Logp:
3.29878
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: C₁₆H₁₆N₄O₃
Molecular Weight: 312.32
Synonyms: None
SMILES: N#CC1=C(N)OC2=C(C1C3=CC=C(C=C3OC)OC)C(C)=NN2
Tpsa: 106.18
Logp: 1.9535
H Acceptors: 6
H Donors: 2
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:
C₁₆H₁₆N₄O₃
Molecular Weight:
312.32
Synonyms:
None
SMILES:
N#CC1=C(N)OC2=C(C1C3=CC=C(C=C3OC)OC)C(C)=NN2
Tpsa:
106.18
Logp:
1.9535
H Acceptors:
6
H Donors:
2
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: C₇H₆N₄S
Molecular Weight: 178.21
Synonyms: None
SMILES: S=C1NN=CN1C1=CN=CC=C1
Tpsa: 46.5
Logp: 1.32489
H Acceptors: 4
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:
C₇H₆N₄S
Molecular Weight:
178.21
Synonyms:
None
SMILES:
S=C1NN=CN1C1=CN=CC=C1
Tpsa:
46.5
Logp:
1.32489
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
1