1-(2-ethyl-7-methylthieno[3,2-d]pyrimidin-4-yl)-3-(2-methoxyethyl)imidazolidin-4-one

C15H20N4O2S — CID 167980817

IUPAC1-(2-ethyl-7-methylthieno[3,2-d]pyrimidin-4-yl)-3-(2-methoxyethyl)imidazolidin-4-one
SMILESCCc1nc(N2CC(=O)N(CCOC)C2)c2scc(C)c2n1
InChIInChI=1S/C15H20N4O2S/c1-4-11-16-13-10(2)8-22-14(13)15(17-11)19-7-12(20)18(9-19)5-6-21-3/h8H,4-7,9H2,1-3H3
InChIKeyRRTRECWESNCOSS-UHFFFAOYSA-N
MW320.42 g/mol
LogP1.81
Rot. Bonds5

About 1-(2-ethyl-7-methylthieno[3,2-d]pyrimidin-4-yl)-3-(2-methoxyethyl)imidazolidin-4-one

1-(2-ethyl-7-methylthieno[3,2-d]pyrimidin-4-yl)-3-(2-methoxyethyl)imidazolidin-4-one (PubChem CID 167980817) has the molecular formula C15H20N4O2S and a molecular weight of 320.42 g/mol. Its IUPAC name is 1-(2-ethyl-7-methylthieno[3,2-d]pyrimidin-4-yl)-3-(2-methoxyethyl)imidazolidin-4-one.

Molecular Properties

Compound Name1-(2-ethyl-7-methylthieno[3,2-d]pyrimidin-4-yl)-3-(2-methoxyethyl)imidazolidin-4-one
PubChem CID167980817
Molecular FormulaC15H20N4O2S
Molecular Weight320.42 g/mol
Exact Mass320.13
IUPAC Name1-(2-ethyl-7-methylthieno[3,2-d]pyrimidin-4-yl)-3-(2-methoxyethyl)imidazolidin-4-one
SMILESCCc1nc(N2CC(=O)N(CCOC)C2)c2scc(C)c2n1
InChIInChI=1S/C15H20N4O2S/c1-4-11-16-13-10(2)8-22-14(13)15(17-11)19-7-12(20)18(9-19)5-6-21-3/h8H,4-7,9H2,1-3H3
InChIKeyRRTRECWESNCOSS-UHFFFAOYSA-N
XLogP1.81
TPSA58.56 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.42
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-(2-ethyl-7-methylthieno[3,2-d]pyrimidin-4-yl)-3-(2-methoxyethyl)imidazolidin-4-one?
The IUPAC name of 1-(2-ethyl-7-methylthieno[3,2-d]pyrimidin-4-yl)-3-(2-methoxyethyl)imidazolidin-4-one (CID 167980817) is 1-(2-ethyl-7-methylthieno[3,2-d]pyrimidin-4-yl)-3-(2-methoxyethyl)imidazolidin-4-one.
What is the SMILES notation for 1-(2-ethyl-7-methylthieno[3,2-d]pyrimidin-4-yl)-3-(2-methoxyethyl)imidazolidin-4-one?
The canonical SMILES for 1-(2-ethyl-7-methylthieno[3,2-d]pyrimidin-4-yl)-3-(2-methoxyethyl)imidazolidin-4-one is CCc1nc(N2CC(=O)N(CCOC)C2)c2scc(C)c2n1.
What is the InChIKey of 1-(2-ethyl-7-methylthieno[3,2-d]pyrimidin-4-yl)-3-(2-methoxyethyl)imidazolidin-4-one?
The InChIKey is RRTRECWESNCOSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2S/c1-4-11-16-13-10(2)8-22-14(13)15(17-11)19-7-12(20)18(9-19)5-6-21-3/h8H,4-7,9H2,1-3H3.
What are the key properties of 1-(2-ethyl-7-methylthieno[3,2-d]pyrimidin-4-yl)-3-(2-methoxyethyl)imidazolidin-4-one?
1-(2-ethyl-7-methylthieno[3,2-d]pyrimidin-4-yl)-3-(2-methoxyethyl)imidazolidin-4-one has a molecular weight of 320.42 g/mol, XLogP of 1.81, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethyl-7-methylthieno[3,2-d]pyrimidin-4-yl)-3-(2-methoxyethyl)imidazolidin-4-one is sourced from PubChem (CID 167980817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).