CS-1142255
5-Nitro-2-((thiophen-2-ylmethyl)amino)pyrimidin-4(3H)-one
Manufacturer: ChemScene
CAS Number: 77961-24-1
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Purity
97%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₉H₈N₄O₃S
Molecular Weight
252.25
Synonyms
None
SMILES
O=C1NC(=NC=C1N(=O)=O)NCC=2SC=CC2
Tpsa
100.92
Logp
1.3517
H Acceptors
6
H Donors
2
Rotatable Bonds
4
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: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₈N₄O₃S
Molecular Weight: 252.25
Synonyms: None
SMILES: O=C1NC(=NC=C1N(=O)=O)NCC=2SC=CC2
Tpsa: 100.92
Logp: 1.3517
H Acceptors: 6
H Donors: 2
Rotatable Bonds: 4
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₈N₄O₃S
Molecular Weight:
252.25
Synonyms:
None
SMILES:
O=C1NC(=NC=C1N(=O)=O)NCC=2SC=CC2
Tpsa:
100.92
Logp:
1.3517
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
4
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₈N₂O₂
Molecular Weight: 188.19
Synonyms: None
SMILES: O=C1NC2=CC=CC=3C(=O)CCN1C23
Tpsa: 54.86
Logp: 0.916
H Acceptors: 3
H Donors: 1
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:
C₁₀H₈N₂O₂
Molecular Weight:
188.19
Synonyms:
None
SMILES:
O=C1NC2=CC=CC=3C(=O)CCN1C23
Tpsa:
54.86
Logp:
0.916
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: C₆H₄BrF₃N₂
Molecular Weight: 241.01
Synonyms: None
SMILES: FC(F)(F)C1=NC(Br)=CC(=N1)C
Tpsa: 25.78
Logp: 2.56632
H Acceptors: 2
H Donors: 0
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:
C₆H₄BrF₃N₂
Molecular Weight:
241.01
Synonyms:
None
SMILES:
FC(F)(F)C1=NC(Br)=CC(=N1)C
Tpsa:
25.78
Logp:
2.56632
H Acceptors:
2
H Donors:
0
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: C₁₃H₁₁FN₄
Molecular Weight: 242.26
Synonyms: None
SMILES: FC=1C=CC=CC1C2=CN=C3C(=NC=CN32)NC
Tpsa: 42.22
Logp: 2.5771
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 2
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₁FN₄
Molecular Weight:
242.26
Synonyms:
None
SMILES:
FC=1C=CC=CC1C2=CN=C3C(=NC=CN32)NC
Tpsa:
42.22
Logp:
2.5771
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2