7-oxo-N-(3,4,5-trimethoxyphenyl)-6H-[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide

C15H14N4O5S — CID 135478154

IUPAC7-oxo-N-(3,4,5-trimethoxyphenyl)-6H-[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide
SMILESCOc1cc(NC(=O)c2snc3c(=O)[nH]cnc23)cc(OC)c1OC
InChIInChI=1S/C15H14N4O5S/c1-22-8-4-7(5-9(23-2)12(8)24-3)18-15(21)13-10-11(19-25-13)14(20)17-6-16-10/h4-6H,1-3H3,(H,18,21)(H,16,17,20)
InChIKeyRIWWZKYQBXBIMB-UHFFFAOYSA-N
MW362.37 g/mol
LogP1.66
Rot. Bonds5

About 7-oxo-N-(3,4,5-trimethoxyphenyl)-6H-[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide

7-oxo-N-(3,4,5-trimethoxyphenyl)-6H-[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide (PubChem CID 135478154) has the molecular formula C15H14N4O5S and a molecular weight of 362.37 g/mol. Its IUPAC name is 7-oxo-N-(3,4,5-trimethoxyphenyl)-6H-[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name7-oxo-N-(3,4,5-trimethoxyphenyl)-6H-[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide
PubChem CID135478154
Molecular FormulaC15H14N4O5S
Molecular Weight362.37 g/mol
Exact Mass362.07
IUPAC Name7-oxo-N-(3,4,5-trimethoxyphenyl)-6H-[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide
SMILESCOc1cc(NC(=O)c2snc3c(=O)[nH]cnc23)cc(OC)c1OC
InChIInChI=1S/C15H14N4O5S/c1-22-8-4-7(5-9(23-2)12(8)24-3)18-15(21)13-10-11(19-25-13)14(20)17-6-16-10/h4-6H,1-3H3,(H,18,21)(H,16,17,20)
InChIKeyRIWWZKYQBXBIMB-UHFFFAOYSA-N
XLogP1.66
TPSA115.43 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.37
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 7-oxo-N-(3,4,5-trimethoxyphenyl)-6H-[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,5-dichloro-N-(3,4,5-trimethoxyphenyl)benzamide
CID 26102136
4-methoxy-N-(3,4,5-trimethoxyphenyl)benzamide
CID 4198373
2-methyl-4-propan-2-yl-N-(3,4,5-trimethoxyphenyl)-1,3-thiazole-5-carboxamide
CID 110676464
2-tert-butyl-4-methyl-N-(3,4,5-trimethoxyphenyl)-1,3-thiazole-5-carboxamide
CID 48980632
2-bromo-N-(3,4,5-trimethoxyphenyl)-1,3-thiazole-4-carboxamide
CID 117087526
2-(prop-2-enylamino)-N-(3,4,5-trimethoxyphenyl)pyrimidine-5-carboxamide
CID 109248020
2-methoxy-N-(3,4,5-trimethoxyphenyl)benzamide
CID 7741659
5-methoxy-N-(3,4,5-trimethoxyphenyl)-1H-indole-3-carboxamide
CID 113206118
7-methyl-4-oxo-N-phenyl-3H-thieno[3,2-d]pyrimidine-6-carboxamide
CID 155811314
3,6-diamino-5-cyano-N-(3,4,5-trimethoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide
CID 3154865
1-methyl-3-(3,4,5-trimethoxyphenyl)urea
CID 17171369
4-phenyl-2-pyrrol-1-yl-N-(3,4,5-trimethoxyphenyl)-1,3-thiazole-5-carboxamide
CID 52898221

Frequently Asked Questions

What is the IUPAC name of 7-oxo-N-(3,4,5-trimethoxyphenyl)-6H-[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide?
The IUPAC name of 7-oxo-N-(3,4,5-trimethoxyphenyl)-6H-[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide (CID 135478154) is 7-oxo-N-(3,4,5-trimethoxyphenyl)-6H-[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide.
What is the SMILES notation for 7-oxo-N-(3,4,5-trimethoxyphenyl)-6H-[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide?
The canonical SMILES for 7-oxo-N-(3,4,5-trimethoxyphenyl)-6H-[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide is COc1cc(NC(=O)c2snc3c(=O)[nH]cnc23)cc(OC)c1OC.
What is the InChIKey of 7-oxo-N-(3,4,5-trimethoxyphenyl)-6H-[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide?
The InChIKey is RIWWZKYQBXBIMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O5S/c1-22-8-4-7(5-9(23-2)12(8)24-3)18-15(21)13-10-11(19-25-13)14(20)17-6-16-10/h4-6H,1-3H3,(H,18,21)(H,16,17,20).
What are the key properties of 7-oxo-N-(3,4,5-trimethoxyphenyl)-6H-[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide?
7-oxo-N-(3,4,5-trimethoxyphenyl)-6H-[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide has a molecular weight of 362.37 g/mol, XLogP of 1.66, 5 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 7-oxo-N-(3,4,5-trimethoxyphenyl)-6H-[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide is sourced from PubChem (CID 135478154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).