1-(4-chlorothieno[3,2-d]pyrimidin-6-yl)ethanol

C8H7ClN2OS — CID 151157827

IUPAC1-(4-chlorothieno[3,2-d]pyrimidin-6-yl)ethanol
SMILESCC(O)c1cc2ncnc(Cl)c2s1
InChIInChI=1S/C8H7ClN2OS/c1-4(12)6-2-5-7(13-6)8(9)11-3-10-5/h2-4,12H,1H3
InChIKeyMZPRHOGUIGXGGD-UHFFFAOYSA-N
MW214.68 g/mol
LogP2.40
Rot. Bonds1

About 1-(4-chlorothieno[3,2-d]pyrimidin-6-yl)ethanol

1-(4-chlorothieno[3,2-d]pyrimidin-6-yl)ethanol (PubChem CID 151157827) has the molecular formula C8H7ClN2OS and a molecular weight of 214.68 g/mol. Its IUPAC name is 1-(4-chlorothieno[3,2-d]pyrimidin-6-yl)ethanol.

Molecular Properties

Compound Name1-(4-chlorothieno[3,2-d]pyrimidin-6-yl)ethanol
PubChem CID151157827
Molecular FormulaC8H7ClN2OS
Molecular Weight214.68 g/mol
Exact Mass214.00
IUPAC Name1-(4-chlorothieno[3,2-d]pyrimidin-6-yl)ethanol
SMILESCC(O)c1cc2ncnc(Cl)c2s1
InChIInChI=1S/C8H7ClN2OS/c1-4(12)6-2-5-7(13-6)8(9)11-3-10-5/h2-4,12H,1H3
InChIKeyMZPRHOGUIGXGGD-UHFFFAOYSA-N
XLogP2.40
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.68
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-Chlorothieno[3,2-d]pyrimidine-6-carboxylic acid
CID 22603621
1-(4-Chlorothieno[3,2-d]pyrimidin-6-yl)-2,2,2-trifluoroethanol
CID 129286178
[1-(4-Chlorothieno[3,2-d]pyrimidin-6-yl)-2,2,2-trifluoroethoxy]-trimethylsilane
CID 149817969
1-(4-Chlorothieno[3,2-d]pyrimidin-6-yl)-2,2,2-trifluoroethanol;[1-(4-chlorothieno[3,2-d]pyrimidin-6-yl)-2,2,2-trifluoroethoxy]-trimethylsilane
CID 161421297
4-Chloro-6-methylthieno[3,2-d]pyrimidine
CID 13683223
{4-Chlorothieno[3,2-d]pyrimidin-6-yl}methanol
CID 57886465
1-(4-Chlorothieno[3,2-d]pyrimidin-6-yl)-2-methylpropan-1-ol
CID 59424561
6-Ethyl-4-chlorothieno[3,2-d]pyrimidine
CID 72207907
3-(4-Chlorothieno[3,2-d]pyrimidin-6-yl)prop-2-yn-1-ol
CID 85843378
1-(2-Chloro-4-morpholin-4-yl-thieno[3,2-d]pyrimidin-6-yl)-ethanol
CID 86618429
(4-Chlorothieno[3,2-d]pyrimidin-7-yl)methanol
CID 86674138
CID 87302028
CID 87302028

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorothieno[3,2-d]pyrimidin-6-yl)ethanol?
The IUPAC name of 1-(4-chlorothieno[3,2-d]pyrimidin-6-yl)ethanol (CID 151157827) is 1-(4-chlorothieno[3,2-d]pyrimidin-6-yl)ethanol.
What is the SMILES notation for 1-(4-chlorothieno[3,2-d]pyrimidin-6-yl)ethanol?
The canonical SMILES for 1-(4-chlorothieno[3,2-d]pyrimidin-6-yl)ethanol is CC(O)c1cc2ncnc(Cl)c2s1.
What is the InChIKey of 1-(4-chlorothieno[3,2-d]pyrimidin-6-yl)ethanol?
The InChIKey is MZPRHOGUIGXGGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7ClN2OS/c1-4(12)6-2-5-7(13-6)8(9)11-3-10-5/h2-4,12H,1H3.
What are the key properties of 1-(4-chlorothieno[3,2-d]pyrimidin-6-yl)ethanol?
1-(4-chlorothieno[3,2-d]pyrimidin-6-yl)ethanol has a molecular weight of 214.68 g/mol, XLogP of 2.40, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorothieno[3,2-d]pyrimidin-6-yl)ethanol is sourced from PubChem (CID 151157827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).