2-methyl-5-phenoxy-4-phenyl-1,3-thiazole

C16H13NOS — CID 154105354

IUPAC2-methyl-5-phenoxy-4-phenyl-1,3-thiazole
SMILESCc1nc(-c2ccccc2)c(Oc2ccccc2)s1
InChIInChI=1S/C16H13NOS/c1-12-17-15(13-8-4-2-5-9-13)16(19-12)18-14-10-6-3-7-11-14/h2-11H,1H3
InChIKeyAEGNYUQQRVCGQJ-UHFFFAOYSA-N
MW267.35 g/mol
LogP4.91
Rot. Bonds3

About 2-methyl-5-phenoxy-4-phenyl-1,3-thiazole

2-methyl-5-phenoxy-4-phenyl-1,3-thiazole (PubChem CID 154105354) has the molecular formula C16H13NOS and a molecular weight of 267.35 g/mol. Its IUPAC name is 2-methyl-5-phenoxy-4-phenyl-1,3-thiazole.

Molecular Properties

Compound Name2-methyl-5-phenoxy-4-phenyl-1,3-thiazole
PubChem CID154105354
Molecular FormulaC16H13NOS
Molecular Weight267.35 g/mol
Exact Mass267.07
IUPAC Name2-methyl-5-phenoxy-4-phenyl-1,3-thiazole
SMILESCc1nc(-c2ccccc2)c(Oc2ccccc2)s1
InChIInChI=1S/C16H13NOS/c1-12-17-15(13-8-4-2-5-9-13)16(19-12)18-14-10-6-3-7-11-14/h2-11H,1H3
InChIKeyAEGNYUQQRVCGQJ-UHFFFAOYSA-N
XLogP4.91
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.35
LogP ≤ 54.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-phenoxy-4-phenyl-1,3-thiazole?
The IUPAC name of 2-methyl-5-phenoxy-4-phenyl-1,3-thiazole (CID 154105354) is 2-methyl-5-phenoxy-4-phenyl-1,3-thiazole.
What is the SMILES notation for 2-methyl-5-phenoxy-4-phenyl-1,3-thiazole?
The canonical SMILES for 2-methyl-5-phenoxy-4-phenyl-1,3-thiazole is Cc1nc(-c2ccccc2)c(Oc2ccccc2)s1.
What is the InChIKey of 2-methyl-5-phenoxy-4-phenyl-1,3-thiazole?
The InChIKey is AEGNYUQQRVCGQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NOS/c1-12-17-15(13-8-4-2-5-9-13)16(19-12)18-14-10-6-3-7-11-14/h2-11H,1H3.
What are the key properties of 2-methyl-5-phenoxy-4-phenyl-1,3-thiazole?
2-methyl-5-phenoxy-4-phenyl-1,3-thiazole has a molecular weight of 267.35 g/mol, XLogP of 4.91, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-phenoxy-4-phenyl-1,3-thiazole is sourced from PubChem (CID 154105354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).