3-phenyl-2-phenylimino-4-(trifluoromethyl)-1,3-thiazolidin-4-ol

C16H13F3N2OS — CID 15717195

IUPAC3-phenyl-2-phenylimino-4-(trifluoromethyl)-1,3-thiazolidin-4-ol
SMILESOC1(C(F)(F)F)CS/C(=N\c2ccccc2)N1c1ccccc1
InChIInChI=1S/C16H13F3N2OS/c17-16(18,19)15(22)11-23-14(20-12-7-3-1-4-8-12)21(15)13-9-5-2-6-10-13/h1-10,22H,11H2/b20-14-
InChIKeySRPHEJAWHWGPHW-ZHZULCJRSA-N
MW338.35 g/mol
LogP4.18
Rot. Bonds2

About 3-phenyl-2-phenylimino-4-(trifluoromethyl)-1,3-thiazolidin-4-ol

3-phenyl-2-phenylimino-4-(trifluoromethyl)-1,3-thiazolidin-4-ol (PubChem CID 15717195) has the molecular formula C16H13F3N2OS and a molecular weight of 338.35 g/mol. Its IUPAC name is 3-phenyl-2-phenylimino-4-(trifluoromethyl)-1,3-thiazolidin-4-ol.

Molecular Properties

Compound Name3-phenyl-2-phenylimino-4-(trifluoromethyl)-1,3-thiazolidin-4-ol
PubChem CID15717195
Molecular FormulaC16H13F3N2OS
Molecular Weight338.35 g/mol
Exact Mass338.07
IUPAC Name3-phenyl-2-phenylimino-4-(trifluoromethyl)-1,3-thiazolidin-4-ol
SMILESOC1(C(F)(F)F)CS/C(=N\c2ccccc2)N1c1ccccc1
InChIInChI=1S/C16H13F3N2OS/c17-16(18,19)15(22)11-23-14(20-12-7-3-1-4-8-12)21(15)13-9-5-2-6-10-13/h1-10,22H,11H2/b20-14-
InChIKeySRPHEJAWHWGPHW-ZHZULCJRSA-N
XLogP4.18
TPSA35.83 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.35
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-phenyl-2-phenylimino-4-(trifluoromethyl)-1,3-thiazolidin-4-ol?
The IUPAC name of 3-phenyl-2-phenylimino-4-(trifluoromethyl)-1,3-thiazolidin-4-ol (CID 15717195) is 3-phenyl-2-phenylimino-4-(trifluoromethyl)-1,3-thiazolidin-4-ol.
What is the SMILES notation for 3-phenyl-2-phenylimino-4-(trifluoromethyl)-1,3-thiazolidin-4-ol?
The canonical SMILES for 3-phenyl-2-phenylimino-4-(trifluoromethyl)-1,3-thiazolidin-4-ol is OC1(C(F)(F)F)CS/C(=N\c2ccccc2)N1c1ccccc1.
What is the InChIKey of 3-phenyl-2-phenylimino-4-(trifluoromethyl)-1,3-thiazolidin-4-ol?
The InChIKey is SRPHEJAWHWGPHW-ZHZULCJRSA-N. The full InChI is InChI=1S/C16H13F3N2OS/c17-16(18,19)15(22)11-23-14(20-12-7-3-1-4-8-12)21(15)13-9-5-2-6-10-13/h1-10,22H,11H2/b20-14-.
What are the key properties of 3-phenyl-2-phenylimino-4-(trifluoromethyl)-1,3-thiazolidin-4-ol?
3-phenyl-2-phenylimino-4-(trifluoromethyl)-1,3-thiazolidin-4-ol has a molecular weight of 338.35 g/mol, XLogP of 4.18, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-2-phenylimino-4-(trifluoromethyl)-1,3-thiazolidin-4-ol is sourced from PubChem (CID 15717195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).