[7-(2-methoxy-4-morpholin-4-ylphenyl)-4-(methylamino)thieno[3,2-d]pyrimidin-2-yl]methanol

C19H22N4O3S — CID 175988852

IUPAC[7-(2-methoxy-4-morpholin-4-ylphenyl)-4-(methylamino)thieno[3,2-d]pyrimidin-2-yl]methanol
SMILESCNc1nc(CO)nc2c(-c3ccc(N4CCOCC4)cc3OC)csc12
InChIInChI=1S/C19H22N4O3S/c1-20-19-18-17(21-16(10-24)22-19)14(11-27-18)13-4-3-12(9-15(13)25-2)23-5-7-26-8-6-23/h3-4,9,11,24H,5-8,10H2,1-2H3,(H,20,21,22)
InChIKeyZCZJBPBIFUPEMN-UHFFFAOYSA-N
MW386.48 g/mol
LogP2.74
Rot. Bonds5

About [7-(2-methoxy-4-morpholin-4-ylphenyl)-4-(methylamino)thieno[3,2-d]pyrimidin-2-yl]methanol

[7-(2-methoxy-4-morpholin-4-ylphenyl)-4-(methylamino)thieno[3,2-d]pyrimidin-2-yl]methanol (PubChem CID 175988852) has the molecular formula C19H22N4O3S and a molecular weight of 386.48 g/mol. Its IUPAC name is [7-(2-methoxy-4-morpholin-4-ylphenyl)-4-(methylamino)thieno[3,2-d]pyrimidin-2-yl]methanol.

Molecular Properties

Compound Name[7-(2-methoxy-4-morpholin-4-ylphenyl)-4-(methylamino)thieno[3,2-d]pyrimidin-2-yl]methanol
PubChem CID175988852
Molecular FormulaC19H22N4O3S
Molecular Weight386.48 g/mol
Exact Mass386.14
IUPAC Name[7-(2-methoxy-4-morpholin-4-ylphenyl)-4-(methylamino)thieno[3,2-d]pyrimidin-2-yl]methanol
SMILESCNc1nc(CO)nc2c(-c3ccc(N4CCOCC4)cc3OC)csc12
InChIInChI=1S/C19H22N4O3S/c1-20-19-18-17(21-16(10-24)22-19)14(11-27-18)13-4-3-12(9-15(13)25-2)23-5-7-26-8-6-23/h3-4,9,11,24H,5-8,10H2,1-2H3,(H,20,21,22)
InChIKeyZCZJBPBIFUPEMN-UHFFFAOYSA-N
XLogP2.74
TPSA79.74 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.48
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze [7-(2-methoxy-4-morpholin-4-ylphenyl)-4-(methylamino)thieno[3,2-d]pyrimidin-2-yl]methanol with MolForge

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Related Compounds

1-ethyl-3-[2-methoxy-4-[2-[(4-morpholin-4-ylphenyl)methyl]thieno[3,2-d]pyrimidin-7-yl]phenyl]urea
CID 58228944
[4-amino-7-(2-methoxy-4-morpholin-4-ylphenyl)-5,5-dimethyl-6H-pyrrolo[2,3-d]pyrimidin-2-yl]methanol
CID 177284257
4-[3,5-dimethoxy-4-[(2-methoxy-4-morpholin-4-ylphenyl)methyl]phenyl]morpholine
CID 135200868
N-(2,2-dimethylpropyl)-2-[(2-methoxy-4-morpholin-4-ylphenyl)methyl]pyrido[3,4-d]pyrimidin-8-amine
CID 146864840
[7-(2-methoxy-4-morpholin-4-ylphenyl)-5,5-dimethyl-6H-pyrrolo[2,3-d]pyrimidin-2-yl]methanol
CID 177284631
4-[4-(1,1-dimethoxyethyl)-3-methoxyphenyl]morpholine
CID 174708451
N-(cyanomethyl)-4-[2-[(4-morpholin-4-ylphenyl)methyl]thieno[3,2-d]pyrimidin-7-yl]benzamide
CID 58228974
N-(2-methoxy-4-morpholin-4-ylphenyl)-4,6-di(piperidin-1-yl)-1,3,5-triazin-2-amine
CID 58865823
4-methoxy-6-morpholin-4-ylquinoline-2-carboxylic acid
CID 102942059
2-ethyl-N-(2-methoxy-5-morpholin-4-ylphenyl)butanamide
CID 110359745
4-methyl-3-[2-[(4-morpholin-4-ylphenyl)methyl]thieno[3,2-d]pyrimidin-7-yl]aniline
CID 58228898
bis((2-methoxy-4-morpholin-4-ylphenyl)diazene);chloride
CID 123629300

Frequently Asked Questions

What is the IUPAC name of [7-(2-methoxy-4-morpholin-4-ylphenyl)-4-(methylamino)thieno[3,2-d]pyrimidin-2-yl]methanol?
The IUPAC name of [7-(2-methoxy-4-morpholin-4-ylphenyl)-4-(methylamino)thieno[3,2-d]pyrimidin-2-yl]methanol (CID 175988852) is [7-(2-methoxy-4-morpholin-4-ylphenyl)-4-(methylamino)thieno[3,2-d]pyrimidin-2-yl]methanol.
What is the SMILES notation for [7-(2-methoxy-4-morpholin-4-ylphenyl)-4-(methylamino)thieno[3,2-d]pyrimidin-2-yl]methanol?
The canonical SMILES for [7-(2-methoxy-4-morpholin-4-ylphenyl)-4-(methylamino)thieno[3,2-d]pyrimidin-2-yl]methanol is CNc1nc(CO)nc2c(-c3ccc(N4CCOCC4)cc3OC)csc12.
What is the InChIKey of [7-(2-methoxy-4-morpholin-4-ylphenyl)-4-(methylamino)thieno[3,2-d]pyrimidin-2-yl]methanol?
The InChIKey is ZCZJBPBIFUPEMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O3S/c1-20-19-18-17(21-16(10-24)22-19)14(11-27-18)13-4-3-12(9-15(13)25-2)23-5-7-26-8-6-23/h3-4,9,11,24H,5-8,10H2,1-2H3,(H,20,21,22).
What are the key properties of [7-(2-methoxy-4-morpholin-4-ylphenyl)-4-(methylamino)thieno[3,2-d]pyrimidin-2-yl]methanol?
[7-(2-methoxy-4-morpholin-4-ylphenyl)-4-(methylamino)thieno[3,2-d]pyrimidin-2-yl]methanol has a molecular weight of 386.48 g/mol, XLogP of 2.74, 5 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [7-(2-methoxy-4-morpholin-4-ylphenyl)-4-(methylamino)thieno[3,2-d]pyrimidin-2-yl]methanol is sourced from PubChem (CID 175988852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).