8-methyl-6-(2-morpholin-4-ylethyl)-2-thieno[3,2-c]pyridin-6-yl-3H-quinazolin-4-one

C22H22N4O2S — CID 146308965

IUPAC8-methyl-6-(2-morpholin-4-ylethyl)-2-thieno[3,2-c]pyridin-6-yl-3H-quinazolin-4-one
SMILESCc1cc(CCN2CCOCC2)cc2c(=O)[nH]c(-c3cc4sccc4cn3)nc12
InChIInChI=1S/C22H22N4O2S/c1-14-10-15(2-4-26-5-7-28-8-6-26)11-17-20(14)24-21(25-22(17)27)18-12-19-16(13-23-18)3-9-29-19/h3,9-13H,2,4-8H2,1H3,(H,24,25,27)
InChIKeySUBGLMBKCDOJBF-UHFFFAOYSA-N
MW406.51 g/mol
LogP3.38
Rot. Bonds4

About 8-methyl-6-(2-morpholin-4-ylethyl)-2-thieno[3,2-c]pyridin-6-yl-3H-quinazolin-4-one

8-methyl-6-(2-morpholin-4-ylethyl)-2-thieno[3,2-c]pyridin-6-yl-3H-quinazolin-4-one (PubChem CID 146308965) has the molecular formula C22H22N4O2S and a molecular weight of 406.51 g/mol. Its IUPAC name is 8-methyl-6-(2-morpholin-4-ylethyl)-2-thieno[3,2-c]pyridin-6-yl-3H-quinazolin-4-one.

Molecular Properties

Compound Name8-methyl-6-(2-morpholin-4-ylethyl)-2-thieno[3,2-c]pyridin-6-yl-3H-quinazolin-4-one
PubChem CID146308965
Molecular FormulaC22H22N4O2S
Molecular Weight406.51 g/mol
Exact Mass406.15
IUPAC Name8-methyl-6-(2-morpholin-4-ylethyl)-2-thieno[3,2-c]pyridin-6-yl-3H-quinazolin-4-one
SMILESCc1cc(CCN2CCOCC2)cc2c(=O)[nH]c(-c3cc4sccc4cn3)nc12
InChIInChI=1S/C22H22N4O2S/c1-14-10-15(2-4-26-5-7-28-8-6-26)11-17-20(14)24-21(25-22(17)27)18-12-19-16(13-23-18)3-9-29-19/h3,9-13H,2,4-8H2,1H3,(H,24,25,27)
InChIKeySUBGLMBKCDOJBF-UHFFFAOYSA-N
XLogP3.38
TPSA71.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.51
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 8-methyl-6-(2-morpholin-4-ylethyl)-2-thieno[3,2-c]pyridin-6-yl-3H-quinazolin-4-one with MolForge

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Related Compounds

8-methyl-6-[(4-methylpiperazin-1-yl)methyl]-2-thieno[2,3-c]pyridin-5-yl-3H-quinazolin-4-one
CID 146308952
N,N-dimethyl-1-[(8-methyl-4-oxo-2-thieno[3,2-c]pyridin-6-yl-3H-quinazolin-6-yl)methyl]piperidine-4-carboxamide
CID 146308909
6-[(2,2-dimethylpiperidin-1-yl)methyl]-8-methyl-2-thieno[3,2-c]pyridin-6-yl-3H-quinazolin-4-one;formamide
CID 175112061
8-methyl-6-(morpholin-4-ylmethyl)-2-pyrrolo[1,2-c]pyrimidin-3-yl-3H-quinazolin-4-one
CID 146308846
8-methyl-6-(morpholin-4-ylmethyl)-2-[4-(trifluoromethyl)-2-pyridinyl]-3H-quinazolin-4-one
CID 146308981
8-methyl-6-[2-(4-methyl-3-oxopiperazin-1-yl)ethyl]-2-[4-(trifluoromethyl)-2-pyridinyl]-3H-quinazolin-4-one;hydrochloride
CID 146308958
(NE)-N-[6-(3-morpholin-4-ylpropyl)-2-thieno[3,2-c]pyridin-6-ylchromen-4-ylidene]hydroxylamine;(NZ)-N-[6-(3-morpholin-4-ylpropyl)-2-thieno[3,2-c]pyridin-6-ylchromen-4-ylidene]hydroxylamine
CID 159858978
2-methyl-5-(2-morpholin-4-ylethyl)benzaldehyde
CID 143796960
6-fluoro-8-methyl-2-morpholin-4-yl-3H-quinazolin-4-one
CID 164995242
4-[2-[(4-propyl-2-thieno[3,2-c]pyridin-6-yl-4H-chromen-6-yl)oxy]ethyl]morpholine
CID 149325736
6-bromo-2-thieno[2,3-c]pyridin-5-yl-3H-quinazolin-4-one
CID 146308864
4-[4-(1-benzothiophen-6-yloxy)butyl]morpholine
CID 153402706

Frequently Asked Questions

What is the IUPAC name of 8-methyl-6-(2-morpholin-4-ylethyl)-2-thieno[3,2-c]pyridin-6-yl-3H-quinazolin-4-one?
The IUPAC name of 8-methyl-6-(2-morpholin-4-ylethyl)-2-thieno[3,2-c]pyridin-6-yl-3H-quinazolin-4-one (CID 146308965) is 8-methyl-6-(2-morpholin-4-ylethyl)-2-thieno[3,2-c]pyridin-6-yl-3H-quinazolin-4-one.
What is the SMILES notation for 8-methyl-6-(2-morpholin-4-ylethyl)-2-thieno[3,2-c]pyridin-6-yl-3H-quinazolin-4-one?
The canonical SMILES for 8-methyl-6-(2-morpholin-4-ylethyl)-2-thieno[3,2-c]pyridin-6-yl-3H-quinazolin-4-one is Cc1cc(CCN2CCOCC2)cc2c(=O)[nH]c(-c3cc4sccc4cn3)nc12.
What is the InChIKey of 8-methyl-6-(2-morpholin-4-ylethyl)-2-thieno[3,2-c]pyridin-6-yl-3H-quinazolin-4-one?
The InChIKey is SUBGLMBKCDOJBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N4O2S/c1-14-10-15(2-4-26-5-7-28-8-6-26)11-17-20(14)24-21(25-22(17)27)18-12-19-16(13-23-18)3-9-29-19/h3,9-13H,2,4-8H2,1H3,(H,24,25,27).
What are the key properties of 8-methyl-6-(2-morpholin-4-ylethyl)-2-thieno[3,2-c]pyridin-6-yl-3H-quinazolin-4-one?
8-methyl-6-(2-morpholin-4-ylethyl)-2-thieno[3,2-c]pyridin-6-yl-3H-quinazolin-4-one has a molecular weight of 406.51 g/mol, XLogP of 3.38, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-6-(2-morpholin-4-ylethyl)-2-thieno[3,2-c]pyridin-6-yl-3H-quinazolin-4-one is sourced from PubChem (CID 146308965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).