6-methyl-4-naphthalen-2-yloxy-5-phenylthieno[2,3-d]pyrimidine

C23H16N2OS — CID 2132400

IUPAC6-methyl-4-naphthalen-2-yloxy-5-phenylthieno[2,3-d]pyrimidine
SMILESCc1sc2ncnc(Oc3ccc4ccccc4c3)c2c1-c1ccccc1
InChIInChI=1S/C23H16N2OS/c1-15-20(17-8-3-2-4-9-17)21-22(24-14-25-23(21)27-15)26-19-12-11-16-7-5-6-10-18(16)13-19/h2-14H,1H3
InChIKeyMSOFTNGZMZXREK-UHFFFAOYSA-N
MW368.46 g/mol
LogP6.61
Rot. Bonds3

About 6-methyl-4-naphthalen-2-yloxy-5-phenylthieno[2,3-d]pyrimidine

6-methyl-4-naphthalen-2-yloxy-5-phenylthieno[2,3-d]pyrimidine (PubChem CID 2132400) has the molecular formula C23H16N2OS and a molecular weight of 368.46 g/mol. Its IUPAC name is 6-methyl-4-naphthalen-2-yloxy-5-phenylthieno[2,3-d]pyrimidine.

Molecular Properties

Compound Name6-methyl-4-naphthalen-2-yloxy-5-phenylthieno[2,3-d]pyrimidine
PubChem CID2132400
Molecular FormulaC23H16N2OS
Molecular Weight368.46 g/mol
Exact Mass368.10
IUPAC Name6-methyl-4-naphthalen-2-yloxy-5-phenylthieno[2,3-d]pyrimidine
SMILESCc1sc2ncnc(Oc3ccc4ccccc4c3)c2c1-c1ccccc1
InChIInChI=1S/C23H16N2OS/c1-15-20(17-8-3-2-4-9-17)21-22(24-14-25-23(21)27-15)26-19-12-11-16-7-5-6-10-18(16)13-19/h2-14H,1H3
InChIKeyMSOFTNGZMZXREK-UHFFFAOYSA-N
XLogP6.61
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.46
LogP ≤ 56.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-Chloro-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidine
CID 708734
5,6-Dimethyl-4-[4-[2-(4-methylphenoxy)ethyl]piperazin-1-yl]thieno[2,3-d]pyrimidine
CID 1999904
4-Phenoxythieno[2,3-d]pyrimidine
CID 710993
7-[5-(4-Methoxyphenyl)thieno[2,3-d]pyrimidin-4-yl]oxy-4-methylchromen-2-one
CID 3788398
4-(4-Methylphenoxy)thieno[2,3-d]pyrimidine
CID 710977
MRGPRX1 agonist 2
CID 719971
MRGPRX1 agonist 3
CID 9212907
N-[2-(4-methoxyphenyl)ethyl]-5-methylthieno[2,3-d]pyrimidin-4-amine
CID 23631944
6-Tert-butyl-4-(2-fluorophenoxy)-5-phenylthieno[2,3-d]pyrimidine
CID 163391841
6-Tert-butyl-4-(2-fluorophenoxy)thieno[2,3-d]pyrimidine
CID 163391869
6-Tert-butyl-4-(2-fluorophenoxy)-5-(4-fluorophenyl)thieno[2,3-d]pyrimidine
CID 163391875
4-Methoxy-6-phenylthieno[2,3-d]pyrimidine
CID 1039883

Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-naphthalen-2-yloxy-5-phenylthieno[2,3-d]pyrimidine?
The IUPAC name of 6-methyl-4-naphthalen-2-yloxy-5-phenylthieno[2,3-d]pyrimidine (CID 2132400) is 6-methyl-4-naphthalen-2-yloxy-5-phenylthieno[2,3-d]pyrimidine.
What is the SMILES notation for 6-methyl-4-naphthalen-2-yloxy-5-phenylthieno[2,3-d]pyrimidine?
The canonical SMILES for 6-methyl-4-naphthalen-2-yloxy-5-phenylthieno[2,3-d]pyrimidine is Cc1sc2ncnc(Oc3ccc4ccccc4c3)c2c1-c1ccccc1.
What is the InChIKey of 6-methyl-4-naphthalen-2-yloxy-5-phenylthieno[2,3-d]pyrimidine?
The InChIKey is MSOFTNGZMZXREK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16N2OS/c1-15-20(17-8-3-2-4-9-17)21-22(24-14-25-23(21)27-15)26-19-12-11-16-7-5-6-10-18(16)13-19/h2-14H,1H3.
What are the key properties of 6-methyl-4-naphthalen-2-yloxy-5-phenylthieno[2,3-d]pyrimidine?
6-methyl-4-naphthalen-2-yloxy-5-phenylthieno[2,3-d]pyrimidine has a molecular weight of 368.46 g/mol, XLogP of 6.61, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-naphthalen-2-yloxy-5-phenylthieno[2,3-d]pyrimidine is sourced from PubChem (CID 2132400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).