7-hydroxy-N-(2-methoxyphenyl)-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

C14H13N3O4S — CID 139603137

IUPAC7-hydroxy-N-(2-methoxyphenyl)-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
SMILESCOc1ccccc1NC(=O)c1c(O)nc2n(c1=O)CCS2
InChIInChI=1S/C14H13N3O4S/c1-21-9-5-3-2-4-8(9)15-11(18)10-12(19)16-14-17(13(10)20)6-7-22-14/h2-5,19H,6-7H2,1H3,(H,15,18)
InChIKeyVINMJYXCIPCZKB-UHFFFAOYSA-N
MW319.34 g/mol
LogP1.32
Rot. Bonds3

About 7-hydroxy-N-(2-methoxyphenyl)-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

7-hydroxy-N-(2-methoxyphenyl)-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide (PubChem CID 139603137) has the molecular formula C14H13N3O4S and a molecular weight of 319.34 g/mol. Its IUPAC name is 7-hydroxy-N-(2-methoxyphenyl)-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide.

Molecular Properties

Compound Name7-hydroxy-N-(2-methoxyphenyl)-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
PubChem CID139603137
Molecular FormulaC14H13N3O4S
Molecular Weight319.34 g/mol
Exact Mass319.06
IUPAC Name7-hydroxy-N-(2-methoxyphenyl)-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
SMILESCOc1ccccc1NC(=O)c1c(O)nc2n(c1=O)CCS2
InChIInChI=1S/C14H13N3O4S/c1-21-9-5-3-2-4-8(9)15-11(18)10-12(19)16-14-17(13(10)20)6-7-22-14/h2-5,19H,6-7H2,1H3,(H,15,18)
InChIKeyVINMJYXCIPCZKB-UHFFFAOYSA-N
XLogP1.32
TPSA93.45 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.34
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

N-(2-methoxy-6-methylphenyl)-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
CID 3707978
6-benzyl-7-(2-methoxyphenoxy)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 4974221
N-(2-methoxyphenyl)-3-(2-oxo-1,3-thiazolidin-3-yl)propanamide
CID 18093399
2-chloro-N-(5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)benzamide
CID 18891698
2,6-dichloro-N-(2-methoxyphenyl)benzamide
CID 853872
N-(2-ethoxyphenyl)-2-hydroxy-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 137279230
6-bromo-N-(2-methoxyphenyl)pyridine-2-carboxamide
CID 103874036
N-(2-methoxyphenyl)-1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxamide
CID 24583509
N-[2-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2,4-dimethoxybenzamide
CID 121148238
5-chloro-N-[2-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-methoxybenzamide
CID 121017054
2-[(2-methoxyphenyl)carbamoyl]benzoic acid
CID 762850
N-(2-nitrophenyl)-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
CID 3568365

Frequently Asked Questions

What is the IUPAC name of 7-hydroxy-N-(2-methoxyphenyl)-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
The IUPAC name of 7-hydroxy-N-(2-methoxyphenyl)-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide (CID 139603137) is 7-hydroxy-N-(2-methoxyphenyl)-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide.
What is the SMILES notation for 7-hydroxy-N-(2-methoxyphenyl)-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
The canonical SMILES for 7-hydroxy-N-(2-methoxyphenyl)-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide is COc1ccccc1NC(=O)c1c(O)nc2n(c1=O)CCS2.
What is the InChIKey of 7-hydroxy-N-(2-methoxyphenyl)-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
The InChIKey is VINMJYXCIPCZKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O4S/c1-21-9-5-3-2-4-8(9)15-11(18)10-12(19)16-14-17(13(10)20)6-7-22-14/h2-5,19H,6-7H2,1H3,(H,15,18).
What are the key properties of 7-hydroxy-N-(2-methoxyphenyl)-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
7-hydroxy-N-(2-methoxyphenyl)-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide has a molecular weight of 319.34 g/mol, XLogP of 1.32, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxy-N-(2-methoxyphenyl)-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide is sourced from PubChem (CID 139603137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).