(5Z)-2-phenyl-5-(phenylsulfanylmethylidene)-4H-1,3-oxazole

C16H13NOS — CID 154707855

IUPAC(5Z)-2-phenyl-5-(phenylsulfanylmethylidene)-4H-1,3-oxazole
SMILESC(\Sc1ccccc1)=C1/CN=C(c2ccccc2)O1
InChIInChI=1S/C16H13NOS/c1-3-7-13(8-4-1)16-17-11-14(18-16)12-19-15-9-5-2-6-10-15/h1-10,12H,11H2/b14-12-
InChIKeyMKFJKGBLIZOGTN-OWBHPGMISA-N
MW267.35 g/mol
LogP4.10
Rot. Bonds3

About (5Z)-2-phenyl-5-(phenylsulfanylmethylidene)-4H-1,3-oxazole

(5Z)-2-phenyl-5-(phenylsulfanylmethylidene)-4H-1,3-oxazole (PubChem CID 154707855) has the molecular formula C16H13NOS and a molecular weight of 267.35 g/mol. Its IUPAC name is (5Z)-2-phenyl-5-(phenylsulfanylmethylidene)-4H-1,3-oxazole.

Molecular Properties

Compound Name(5Z)-2-phenyl-5-(phenylsulfanylmethylidene)-4H-1,3-oxazole
PubChem CID154707855
Molecular FormulaC16H13NOS
Molecular Weight267.35 g/mol
Exact Mass267.07
IUPAC Name(5Z)-2-phenyl-5-(phenylsulfanylmethylidene)-4H-1,3-oxazole
SMILESC(\Sc1ccccc1)=C1/CN=C(c2ccccc2)O1
InChIInChI=1S/C16H13NOS/c1-3-7-13(8-4-1)16-17-11-14(18-16)12-19-15-9-5-2-6-10-15/h1-10,12H,11H2/b14-12-
InChIKeyMKFJKGBLIZOGTN-OWBHPGMISA-N
XLogP4.10
TPSA21.59 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 ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (5Z)-2-phenyl-5-(phenylsulfanylmethylidene)-4H-1,3-oxazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (5Z)-2-phenyl-5-(phenylsulfanylmethylidene)-4H-1,3-oxazole?
The IUPAC name of (5Z)-2-phenyl-5-(phenylsulfanylmethylidene)-4H-1,3-oxazole (CID 154707855) is (5Z)-2-phenyl-5-(phenylsulfanylmethylidene)-4H-1,3-oxazole.
What is the SMILES notation for (5Z)-2-phenyl-5-(phenylsulfanylmethylidene)-4H-1,3-oxazole?
The canonical SMILES for (5Z)-2-phenyl-5-(phenylsulfanylmethylidene)-4H-1,3-oxazole is C(\Sc1ccccc1)=C1/CN=C(c2ccccc2)O1.
What is the InChIKey of (5Z)-2-phenyl-5-(phenylsulfanylmethylidene)-4H-1,3-oxazole?
The InChIKey is MKFJKGBLIZOGTN-OWBHPGMISA-N. The full InChI is InChI=1S/C16H13NOS/c1-3-7-13(8-4-1)16-17-11-14(18-16)12-19-15-9-5-2-6-10-15/h1-10,12H,11H2/b14-12-.
What are the key properties of (5Z)-2-phenyl-5-(phenylsulfanylmethylidene)-4H-1,3-oxazole?
(5Z)-2-phenyl-5-(phenylsulfanylmethylidene)-4H-1,3-oxazole has a molecular weight of 267.35 g/mol, XLogP of 4.10, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-2-phenyl-5-(phenylsulfanylmethylidene)-4H-1,3-oxazole is sourced from PubChem (CID 154707855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).