CS-0293445
2-((4,6-Diamino-1,3,5-triazin-2-yl)thio)-1-(pyrrolidin-1-yl)ethan-1-one
Manufacturer: ChemScene
CAS Number: 871093-68-4
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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
C₉H₁₄N₆OS
Molecular Weight
254.31
Synonyms
None
SMILES
O=C(N1CCCC1)CSC2=NC(N)=NC(N)=N2
Tpsa
111.02
Logp
-0.2495
H Acceptors
7
H Donors
2
Rotatable Bonds
3
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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: C₉H₁₄N₆OS
Molecular Weight: 254.31
Synonyms: None
SMILES: O=C(N1CCCC1)CSC2=NC(N)=NC(N)=N2
Tpsa: 111.02
Logp: -0.2495
H Acceptors: 7
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:
C₉H₁₄N₆OS
Molecular Weight:
254.31
Synonyms:
None
SMILES:
O=C(N1CCCC1)CSC2=NC(N)=NC(N)=N2
Tpsa:
111.02
Logp:
-0.2495
H Acceptors:
7
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: C₁₁H₁₅N₃O₃S
Molecular Weight: 269.32
Synonyms: None
SMILES: O=C(N1CCCC1)NC2=CC=C(S(=O)(N)=O)C=C2
Tpsa: 92.5
Logp: 0.9617
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:
C₁₁H₁₅N₃O₃S
Molecular Weight:
269.32
Synonyms:
None
SMILES:
O=C(N1CCCC1)NC2=CC=C(S(=O)(N)=O)C=C2
Tpsa:
92.5
Logp:
0.9617
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: C₁₁H₁₃BrN₂O
Molecular Weight: 269.14
Synonyms: None
SMILES: O=C(N1CCCC1)NC2=CC=CC(Br)=C2
Tpsa: 32.34
Logp: 3.0768
H Acceptors: 1
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:
C₁₁H₁₃BrN₂O
Molecular Weight:
269.14
Synonyms:
None
SMILES:
O=C(N1CCCC1)NC2=CC=CC(Br)=C2
Tpsa:
32.34
Logp:
3.0768
H Acceptors:
1
H Donors:
1
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: C₁₁H₁₁ClN₂O₃
Molecular Weight: 254.67
Synonyms: 2-Chloro-1-(6-nitro-1,2,3,4-tetrahydroquinolin-1-yl)ethan-1-one
SMILES: O=C(N1CCCC2=C1C=CC([N+]([O-])=O)=C2)CCl
Tpsa: 63.45
Logp: 2.1128
H Acceptors: 3
H Donors: 0
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:
C₁₁H₁₁ClN₂O₃
Molecular Weight:
254.67
Synonyms:
2-Chloro-1-(6-nitro-1,2,3,4-tetrahydroquinolin-1-yl)ethan-1-one
SMILES:
O=C(N1CCCC2=C1C=CC([N+]([O-])=O)=C2)CCl
Tpsa:
63.45
Logp:
2.1128
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
2