CS-0498698
7-(Methylthio)-3,4-dihydropyrimido[4,5-d]pyrimidin-2(1H)-one
Manufacturer: ChemScene
CAS Number: 1552739-71-5
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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
C₇H₈N₄OS
Molecular Weight
196.23
Synonyms
None
SMILES
O=C1NC2=NC(SC)=NC=C2CN1
Tpsa
66.91
Logp
0.8336
H Acceptors
4
H Donors
2
Rotatable Bonds
1
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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: C₇H₈N₄OS
Molecular Weight: 196.23
Synonyms: None
SMILES: O=C1NC2=NC(SC)=NC=C2CN1
Tpsa: 66.91
Logp: 0.8336
H Acceptors: 4
H Donors: 2
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:
C₇H₈N₄OS
Molecular Weight:
196.23
Synonyms:
None
SMILES:
O=C1NC2=NC(SC)=NC=C2CN1
Tpsa:
66.91
Logp:
0.8336
H Acceptors:
4
H Donors:
2
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: C₇H₆BrNS
Molecular Weight: 216.10
Synonyms: None
SMILES: N#CC1=C(CC)C(Br)=CS1
Tpsa: 23.79
Logp: 2.94468
H Acceptors: 2
H Donors: 0
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:
C₇H₆BrNS
Molecular Weight:
216.10
Synonyms:
None
SMILES:
N#CC1=C(CC)C(Br)=CS1
Tpsa:
23.79
Logp:
2.94468
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
1
Purity: 98%
MDL No: MFCD22381233
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₄BrNOS
Molecular Weight: 206.06
Synonyms: 1-(2-broMothiazol-4-yl)ethanone
SMILES: CC(C1=CSC(Br)=N1)=O
Tpsa: 29.96
Logp: 2.1082
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD22381233
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₄BrNOS
Molecular Weight:
206.06
Synonyms:
1-(2-broMothiazol-4-yl)ethanone
SMILES:
CC(C1=CSC(Br)=N1)=O
Tpsa:
29.96
Logp:
2.1082
H Acceptors:
3
H Donors:
0
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: C₁₂H₁₄N₂S
Molecular Weight: 218.32
Synonyms: (S)-1-(4-(4-methylthiazol-5-yl)phenyl)ethan-1-amine
SMILES: CC1=C(C2=CC=C(C=C2)[C@@H](N)C)SC=N1
Tpsa: 38.91
Logp: 3.13822
H Acceptors: 3
H Donors: 1
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:
C₁₂H₁₄N₂S
Molecular Weight:
218.32
Synonyms:
(S)-1-(4-(4-methylthiazol-5-yl)phenyl)ethan-1-amine
SMILES:
CC1=C(C2=CC=C(C=C2)[C@@H](N)C)SC=N1
Tpsa:
38.91
Logp:
3.13822
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2