3-Isobutyl-2-mercapto-5,6-dimethylthieno[2,3-d]pyrimidin-4(3H)-one

Name: 3-Isobutyl-2-mercapto-5,6-dimethylthieno[2,3-d]pyrimidin-4(3H)-one
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CAS No. 731827-20-6
Cat. No. CS-0484207
Purity≥98%
MDL No.MFCD04632089

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3-Isobutyl-2-mercapto-5,6-dimethylthieno[2,3-d]pyrimidin-4(3H)-one|CS-0484207

Structure of 731827-20-6

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General Information

CAS No. 731827-20-6
Cat. No. CS-0484207
Purity ≥98%
MDL No. MFCD04632089
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₂H₁₆N₂OS₂
Molecular Weight 268.40
Synonym(s) None
SMILES CC(C)CN1C(S)=NC2=C(C(C)=C(C)S2)C1=O

Safety Information

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GHS Pictogram : N/A	GHS No : N/A
Signal Word : N/A	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

TPSA 34.89
LogP 3.01954
H_Acceptors 5
H_Donors 1
Rotatable_Bonds 2

Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Pyrimidine compounds

Building Blocks Skeleton Aromatic heterocycle compounds Thiophene compounds

Key Words

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3-Isobutyl-2-mercapto-5,6-dimethylthieno[2,3-d]pyrimidin-4(3H)-one

CAS No. 731827-20-6

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