2-(2-morpholin-4-yl-5-oxo-7-thiophen-2-yl-[1,3]thiazolo[5,4-d]pyrimidin-4-yl)-N-(2-phenylethyl)acetamide

C23H23N5O3S2 — CID 39859239

IUPAC2-(2-morpholin-4-yl-5-oxo-7-thiophen-2-yl-[1,3]thiazolo[5,4-d]pyrimidin-4-yl)-N-(2-phenylethyl)acetamide
SMILESO=C(Cn1c(=O)nc(-c2cccs2)c2nc(N3CCOCC3)sc21)NCCc1ccccc1
InChIInChI=1S/C23H23N5O3S2/c29-18(24-9-8-16-5-2-1-3-6-16)15-28-21-20(19(25-22(28)30)17-7-4-14-32-17)26-23(33-21)27-10-12-31-13-11-27/h1-7,14H,8-13,15H2,(H,24,29)
InChIKeyWGPBLFQVTCEOJJ-UHFFFAOYSA-N
MW481.60 g/mol
LogP2.78
Rot. Bonds7

About 2-(2-morpholin-4-yl-5-oxo-7-thiophen-2-yl-[1,3]thiazolo[5,4-d]pyrimidin-4-yl)-N-(2-phenylethyl)acetamide

2-(2-morpholin-4-yl-5-oxo-7-thiophen-2-yl-[1,3]thiazolo[5,4-d]pyrimidin-4-yl)-N-(2-phenylethyl)acetamide (PubChem CID 39859239) has the molecular formula C23H23N5O3S2 and a molecular weight of 481.60 g/mol. Its IUPAC name is 2-(2-morpholin-4-yl-5-oxo-7-thiophen-2-yl-[1,3]thiazolo[5,4-d]pyrimidin-4-yl)-N-(2-phenylethyl)acetamide.

Molecular Properties

Compound Name2-(2-morpholin-4-yl-5-oxo-7-thiophen-2-yl-[1,3]thiazolo[5,4-d]pyrimidin-4-yl)-N-(2-phenylethyl)acetamide
PubChem CID39859239
Molecular FormulaC23H23N5O3S2
Molecular Weight481.60 g/mol
Exact Mass481.12
IUPAC Name2-(2-morpholin-4-yl-5-oxo-7-thiophen-2-yl-[1,3]thiazolo[5,4-d]pyrimidin-4-yl)-N-(2-phenylethyl)acetamide
SMILESO=C(Cn1c(=O)nc(-c2cccs2)c2nc(N3CCOCC3)sc21)NCCc1ccccc1
InChIInChI=1S/C23H23N5O3S2/c29-18(24-9-8-16-5-2-1-3-6-16)15-28-21-20(19(25-22(28)30)17-7-4-14-32-17)26-23(33-21)27-10-12-31-13-11-27/h1-7,14H,8-13,15H2,(H,24,29)
InChIKeyWGPBLFQVTCEOJJ-UHFFFAOYSA-N
XLogP2.78
TPSA89.35 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500481.60
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Analyze 2-(2-morpholin-4-yl-5-oxo-7-thiophen-2-yl-[1,3]thiazolo[5,4-d]pyrimidin-4-yl)-N-(2-phenylethyl)acetamide with MolForge

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Related Compounds

N-(2-ethoxyphenyl)-2-(2-morpholin-4-yl-5-oxo-7-phenyl-[1,3]thiazolo[5,4-d]pyrimidin-4-yl)acetamide
CID 39859192
N-[(4-fluorophenyl)methyl]-2-(2-methyl-5-oxo-7-thiophen-2-yl-[1,3]thiazolo[5,4-d]pyrimidin-4-yl)acetamide
CID 39859480
2-[7-(furan-2-yl)-5-oxo-2-pyrrolidin-1-yl-[1,3]thiazolo[5,4-d]pyrimidin-4-yl]-N-phenylacetamide
CID 39858907
4-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-2-morpholin-4-yl-7-phenyl-[1,3]thiazolo[5,4-d]pyrimidin-5-one
CID 39859306
N-cyclopentyl-2-(2-morpholin-4-yl-4-oxo-7-thiophen-2-yl-[1,3]thiazolo[4,5-d]pyridazin-5-yl)acetamide
CID 42099963
2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)-N-(2-phenylethyl)acetamide
CID 51052835
4-(5-phenyl-4-thiophen-2-yl-1,3-thiazol-2-yl)morpholine
CID 15724124
2-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-1-yl]-N-(2-phenylethyl)acetamide
CID 30653596
2-(4-morpholin-4-yl-1-oxo-[1,2,4]triazolo[4,3-a]quinoxalin-2-yl)-N-(2-phenylethyl)acetamide
CID 50787727
3-morpholin-4-yl-N-(2-phenylethyl)propanamide
CID 779164
2-morpholin-4-yl-N-pyridin-2-yl-4-thiophen-2-yl-1,3-thiazole-5-carbothioamide
CID 5253122
4-morpholin-4-yl-N-(2-phenylethyl)quinazoline-2-carboxamide
CID 53012870

Frequently Asked Questions

What is the IUPAC name of 2-(2-morpholin-4-yl-5-oxo-7-thiophen-2-yl-[1,3]thiazolo[5,4-d]pyrimidin-4-yl)-N-(2-phenylethyl)acetamide?
The IUPAC name of 2-(2-morpholin-4-yl-5-oxo-7-thiophen-2-yl-[1,3]thiazolo[5,4-d]pyrimidin-4-yl)-N-(2-phenylethyl)acetamide (CID 39859239) is 2-(2-morpholin-4-yl-5-oxo-7-thiophen-2-yl-[1,3]thiazolo[5,4-d]pyrimidin-4-yl)-N-(2-phenylethyl)acetamide.
What is the SMILES notation for 2-(2-morpholin-4-yl-5-oxo-7-thiophen-2-yl-[1,3]thiazolo[5,4-d]pyrimidin-4-yl)-N-(2-phenylethyl)acetamide?
The canonical SMILES for 2-(2-morpholin-4-yl-5-oxo-7-thiophen-2-yl-[1,3]thiazolo[5,4-d]pyrimidin-4-yl)-N-(2-phenylethyl)acetamide is O=C(Cn1c(=O)nc(-c2cccs2)c2nc(N3CCOCC3)sc21)NCCc1ccccc1.
What is the InChIKey of 2-(2-morpholin-4-yl-5-oxo-7-thiophen-2-yl-[1,3]thiazolo[5,4-d]pyrimidin-4-yl)-N-(2-phenylethyl)acetamide?
The InChIKey is WGPBLFQVTCEOJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N5O3S2/c29-18(24-9-8-16-5-2-1-3-6-16)15-28-21-20(19(25-22(28)30)17-7-4-14-32-17)26-23(33-21)27-10-12-31-13-11-27/h1-7,14H,8-13,15H2,(H,24,29).
What are the key properties of 2-(2-morpholin-4-yl-5-oxo-7-thiophen-2-yl-[1,3]thiazolo[5,4-d]pyrimidin-4-yl)-N-(2-phenylethyl)acetamide?
2-(2-morpholin-4-yl-5-oxo-7-thiophen-2-yl-[1,3]thiazolo[5,4-d]pyrimidin-4-yl)-N-(2-phenylethyl)acetamide has a molecular weight of 481.60 g/mol, XLogP of 2.78, 7 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-morpholin-4-yl-5-oxo-7-thiophen-2-yl-[1,3]thiazolo[5,4-d]pyrimidin-4-yl)-N-(2-phenylethyl)acetamide is sourced from PubChem (CID 39859239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).