2,3,5,6,7,8-Hexahydro-3-pentyl-2-thioxo[1]benzothieno[2,3-d]pyrimidin-4(1H)-one

Name: 2,3,5,6,7,8-Hexahydro-3-pentyl-2-thioxo[1]benzothieno[2,3-d]pyrimidin-4(1H)-one
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CAS No. 565171-27-9
Cat. No. CS-0220559
Molecule weight308.46
Purity≥95%
MDL No.None

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2,3,5,6,7,8-Hexahydro-3-pentyl-2-thioxo[1]benzothieno[2,3-d]pyrimidin-4(1H)-one|CS-0220559

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General Information

CAS No. 565171-27-9
Cat. No. CS-0220559
Purity ≥95%
MDL No. None
Storage 4°C, stored under nitrogen
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₅H₂₀N₂OS₂
Molecular Weight 308.46
Synonym(s) 4-Pentyl-5-sulfanyl-8-thia-4,6-diazatricyclo[7.4.0.0,2,7]trideca-1(9),2(7),5-trien-3-one
SMILES O=C1C(C2=C(CCCC2)S3)=C3N=C(S)N1CCCCC

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 3.8157
H_Acceptors 5
H_Donors 1
Rotatable_Bonds 4

Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Pyrimidine compounds

Building Blocks Skeleton Aromatic heterocycle compounds Thiophene compounds

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2,3,5,6,7,8-Hexahydro-3-pentyl-2-thioxo[1]benzothieno[2,3-d]pyrimidin-4(1H)-one

CAS No. 565171-27-9

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