2-methyl-N-(4-oxo-3H-quinazolin-8-yl)-5-phenyl-1,3-thiazole-4-carboxamide

C19H14N4O2S — CID 167965755

IUPAC2-methyl-N-(4-oxo-3H-quinazolin-8-yl)-5-phenyl-1,3-thiazole-4-carboxamide
SMILESCc1nc(C(=O)Nc2cccc3c(=O)[nH]cnc23)c(-c2ccccc2)s1
InChIInChI=1S/C19H14N4O2S/c1-11-22-16(17(26-11)12-6-3-2-4-7-12)19(25)23-14-9-5-8-13-15(14)20-10-21-18(13)24/h2-10H,1H3,(H,23,25)(H,20,21,24)
InChIKeyQXNIPFAQOFZQEZ-UHFFFAOYSA-N
MW362.41 g/mol
LogP3.61
Rot. Bonds3

About 2-methyl-N-(4-oxo-3H-quinazolin-8-yl)-5-phenyl-1,3-thiazole-4-carboxamide

2-methyl-N-(4-oxo-3H-quinazolin-8-yl)-5-phenyl-1,3-thiazole-4-carboxamide (PubChem CID 167965755) has the molecular formula C19H14N4O2S and a molecular weight of 362.41 g/mol. Its IUPAC name is 2-methyl-N-(4-oxo-3H-quinazolin-8-yl)-5-phenyl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(4-oxo-3H-quinazolin-8-yl)-5-phenyl-1,3-thiazole-4-carboxamide
PubChem CID167965755
Molecular FormulaC19H14N4O2S
Molecular Weight362.41 g/mol
Exact Mass362.08
IUPAC Name2-methyl-N-(4-oxo-3H-quinazolin-8-yl)-5-phenyl-1,3-thiazole-4-carboxamide
SMILESCc1nc(C(=O)Nc2cccc3c(=O)[nH]cnc23)c(-c2ccccc2)s1
InChIInChI=1S/C19H14N4O2S/c1-11-22-16(17(26-11)12-6-3-2-4-7-12)19(25)23-14-9-5-8-13-15(14)20-10-21-18(13)24/h2-10H,1H3,(H,23,25)(H,20,21,24)
InChIKeyQXNIPFAQOFZQEZ-UHFFFAOYSA-N
XLogP3.61
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.41
LogP ≤ 53.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-methyl-N-(4-oxo-3H-quinazolin-8-yl)-5-phenyl-1,3-thiazole-4-carboxamide with MolForge

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Related Compounds

ethyl 2-[(2-methyl-5-phenyl-1,3-thiazole-4-carbonyl)amino]benzoate
CID 110651262
N-(5-chloro-2-methylphenyl)-2-methyl-5-phenyl-1,3-thiazole-4-carboxamide
CID 43854702
N-cyclopentyl-2-methyl-5-phenyl-1,3-thiazole-4-carboxamide
CID 110647439
2-methyl-5-phenyl-N-(4-phenyl-1,2,5-oxadiazol-3-yl)-1,3-thiazole-4-carboxamide
CID 43854828
2-methyl-5-phenyl-N-[3-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxamide
CID 43854625
N-(3-chloro-4-methylphenyl)-2-methyl-5-phenyl-1,3-thiazole-4-carboxamide
CID 43854642
2-methyl-5-phenyl-N-(4-sulfamoylphenyl)-1,3-thiazole-4-carboxamide
CID 43854628
2-methyl-N-(5-nitro-1,3-oxazol-2-yl)-5-phenyl-1,3-thiazole-4-carboxamide
CID 43854861
1-cyclopropyl-6-oxo-N-(4-oxo-3H-quinazolin-8-yl)pyridine-3-carboxamide
CID 167891274
N-[(2S)-1-aminopropan-2-yl]-2-methyl-5-phenyl-1,3-thiazole-4-carboxamide
CID 68727128
N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-2-methyl-5-phenyl-1,3-thiazole-4-carboxamide
CID 43854818
7-methyl-4-oxo-N-phenyl-3H-thieno[3,2-d]pyrimidine-6-carboxamide
CID 155811314

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(4-oxo-3H-quinazolin-8-yl)-5-phenyl-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-methyl-N-(4-oxo-3H-quinazolin-8-yl)-5-phenyl-1,3-thiazole-4-carboxamide (CID 167965755) is 2-methyl-N-(4-oxo-3H-quinazolin-8-yl)-5-phenyl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-methyl-N-(4-oxo-3H-quinazolin-8-yl)-5-phenyl-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-methyl-N-(4-oxo-3H-quinazolin-8-yl)-5-phenyl-1,3-thiazole-4-carboxamide is Cc1nc(C(=O)Nc2cccc3c(=O)[nH]cnc23)c(-c2ccccc2)s1.
What is the InChIKey of 2-methyl-N-(4-oxo-3H-quinazolin-8-yl)-5-phenyl-1,3-thiazole-4-carboxamide?
The InChIKey is QXNIPFAQOFZQEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N4O2S/c1-11-22-16(17(26-11)12-6-3-2-4-7-12)19(25)23-14-9-5-8-13-15(14)20-10-21-18(13)24/h2-10H,1H3,(H,23,25)(H,20,21,24).
What are the key properties of 2-methyl-N-(4-oxo-3H-quinazolin-8-yl)-5-phenyl-1,3-thiazole-4-carboxamide?
2-methyl-N-(4-oxo-3H-quinazolin-8-yl)-5-phenyl-1,3-thiazole-4-carboxamide has a molecular weight of 362.41 g/mol, XLogP of 3.61, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(4-oxo-3H-quinazolin-8-yl)-5-phenyl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 167965755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).