4-(2-phenylphenoxy)-2-(2H-tetrazol-5-yl)thieno[2,3-c]pyridine

C20H13N5OS — CID 44580677

IUPAC4-(2-phenylphenoxy)-2-(2H-tetrazol-5-yl)thieno[2,3-c]pyridine
SMILESc1ccc(-c2ccccc2Oc2cncc3sc(-c4nn[nH]n4)cc23)cc1
InChIInChI=1S/C20H13N5OS/c1-2-6-13(7-3-1)14-8-4-5-9-16(14)26-17-11-21-12-19-15(17)10-18(27-19)20-22-24-25-23-20/h1-12H,(H,22,23,24,25)
InChIKeyGYSCTANYYJXRDQ-UHFFFAOYSA-N
MW371.43 g/mol
LogP4.94
Rot. Bonds4

About 4-(2-phenylphenoxy)-2-(2H-tetrazol-5-yl)thieno[2,3-c]pyridine

4-(2-phenylphenoxy)-2-(2H-tetrazol-5-yl)thieno[2,3-c]pyridine (PubChem CID 44580677) has the molecular formula C20H13N5OS and a molecular weight of 371.43 g/mol. Its IUPAC name is 4-(2-phenylphenoxy)-2-(2H-tetrazol-5-yl)thieno[2,3-c]pyridine.

Molecular Properties

Compound Name4-(2-phenylphenoxy)-2-(2H-tetrazol-5-yl)thieno[2,3-c]pyridine
PubChem CID44580677
Molecular FormulaC20H13N5OS
Molecular Weight371.43 g/mol
Exact Mass371.08
IUPAC Name4-(2-phenylphenoxy)-2-(2H-tetrazol-5-yl)thieno[2,3-c]pyridine
SMILESc1ccc(-c2ccccc2Oc2cncc3sc(-c4nn[nH]n4)cc23)cc1
InChIInChI=1S/C20H13N5OS/c1-2-6-13(7-3-1)14-8-4-5-9-16(14)26-17-11-21-12-19-15(17)10-18(27-19)20-22-24-25-23-20/h1-12H,(H,22,23,24,25)
InChIKeyGYSCTANYYJXRDQ-UHFFFAOYSA-N
XLogP4.94
TPSA76.58 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.43
LogP ≤ 54.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-(3-propan-2-yloxyphenoxy)-2-(2H-tetrazol-5-yl)thieno[2,3-c]pyridine
CID 58622650
5-(2-phenylphenoxy)-1H-pyrimidin-6-one
CID 134086611
methoxymethane;4-methyl-2-phenylthieno[2,3-c]pyridine
CID 91395588
5-[3-(2-methoxyphenyl)phenyl]-2H-tetrazole;2-[3-(2H-tetrazol-5-yl)phenyl]phenol
CID 161184284
5-chloro-2-[2-(2H-tetrazol-5-yl)phenoxy]phenol
CID 157441605
5-[2-(difluoromethoxy)phenyl]-2H-tetrazole
CID 7017704
5-(2-methyl-6-phenylphenyl)-2H-tetrazole;hydrate
CID 172761418
1-phenyl-2-[2-[2-(2-phenylphenyl)phenoxy]phenyl]benzene
CID 67263079
1-(2-phenoxyphenyl)-2-(2-phenylphenoxy)benzene
CID 54513484
3-methoxy-2,6-dimethyl-4-[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]pyridine
CID 151578231
5-(bromomethyl)-2-(2-phenylphenoxy)pyrimidine
CID 107086555
2-phenyl-4-[2-(2H-tetrazol-5-yl)phenyl]-1,3,5-triazine
CID 173146131

Frequently Asked Questions

What is the IUPAC name of 4-(2-phenylphenoxy)-2-(2H-tetrazol-5-yl)thieno[2,3-c]pyridine?
The IUPAC name of 4-(2-phenylphenoxy)-2-(2H-tetrazol-5-yl)thieno[2,3-c]pyridine (CID 44580677) is 4-(2-phenylphenoxy)-2-(2H-tetrazol-5-yl)thieno[2,3-c]pyridine.
What is the SMILES notation for 4-(2-phenylphenoxy)-2-(2H-tetrazol-5-yl)thieno[2,3-c]pyridine?
The canonical SMILES for 4-(2-phenylphenoxy)-2-(2H-tetrazol-5-yl)thieno[2,3-c]pyridine is c1ccc(-c2ccccc2Oc2cncc3sc(-c4nn[nH]n4)cc23)cc1.
What is the InChIKey of 4-(2-phenylphenoxy)-2-(2H-tetrazol-5-yl)thieno[2,3-c]pyridine?
The InChIKey is GYSCTANYYJXRDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13N5OS/c1-2-6-13(7-3-1)14-8-4-5-9-16(14)26-17-11-21-12-19-15(17)10-18(27-19)20-22-24-25-23-20/h1-12H,(H,22,23,24,25).
What are the key properties of 4-(2-phenylphenoxy)-2-(2H-tetrazol-5-yl)thieno[2,3-c]pyridine?
4-(2-phenylphenoxy)-2-(2H-tetrazol-5-yl)thieno[2,3-c]pyridine has a molecular weight of 371.43 g/mol, XLogP of 4.94, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-phenylphenoxy)-2-(2H-tetrazol-5-yl)thieno[2,3-c]pyridine is sourced from PubChem (CID 44580677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).