2-[3,4-bis(phenylmethoxy)phenyl]-1,3-thiazole

C23H19NO2S — CID 25131159

IUPAC2-[3,4-bis(phenylmethoxy)phenyl]-1,3-thiazole
SMILESc1ccc(COc2ccc(-c3nccs3)cc2OCc2ccccc2)cc1
InChIInChI=1S/C23H19NO2S/c1-3-7-18(8-4-1)16-25-21-12-11-20(23-24-13-14-27-23)15-22(21)26-17-19-9-5-2-6-10-19/h1-15H,16-17H2
InChIKeyHLZPNRFEWQMMSI-UHFFFAOYSA-N
MW373.48 g/mol
LogP5.97
Rot. Bonds7

About 2-[3,4-bis(phenylmethoxy)phenyl]-1,3-thiazole

2-[3,4-bis(phenylmethoxy)phenyl]-1,3-thiazole (PubChem CID 25131159) has the molecular formula C23H19NO2S and a molecular weight of 373.48 g/mol. Its IUPAC name is 2-[3,4-bis(phenylmethoxy)phenyl]-1,3-thiazole.

Molecular Properties

Compound Name2-[3,4-bis(phenylmethoxy)phenyl]-1,3-thiazole
PubChem CID25131159
Molecular FormulaC23H19NO2S
Molecular Weight373.48 g/mol
Exact Mass373.11
IUPAC Name2-[3,4-bis(phenylmethoxy)phenyl]-1,3-thiazole
SMILESc1ccc(COc2ccc(-c3nccs3)cc2OCc2ccccc2)cc1
InChIInChI=1S/C23H19NO2S/c1-3-7-18(8-4-1)16-25-21-12-11-20(23-24-13-14-27-23)15-22(21)26-17-19-9-5-2-6-10-19/h1-15H,16-17H2
InChIKeyHLZPNRFEWQMMSI-UHFFFAOYSA-N
XLogP5.97
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500373.48
LogP ≤ 55.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-[3,4-bis(phenylmethoxy)phenyl]-1,3-thiazole with MolForge

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

Launch Full Analysis

Related Compounds

2-(3-phenylpropoxy)-5-(1,3-thiazol-2-yl)aniline
CID 94758847
2-[4-(1,3-thiazol-2-yl)phenyl]-1,3-thiazole
CID 901538
2-[6-(4-phenylmethoxyquinolin-6-yl)-2-pyridinyl]-1,3-thiazole
CID 58387591
2-(3-ethoxy-4-phenylmethoxyphenyl)-1,3-benzothiazole
CID 126197669
2,4-bis(phenylmethoxy)-7-(1,3-thiazol-2-yl)-1,3-benzoxazole
CID 166456975
N'-methyl-N'-[[2-[[3-(1,3-thiazol-2-yl)phenyl]methoxy]phenyl]methyl]ethane-1,2-diamine
CID 177382829
2-[2-(pyridin-3-ylmethoxy)phenyl]-1,3-thiazole
CID 99839545
2,3,6,7,10,11-hexakis(phenylmethoxy)triphenylene
CID 11040205
2-(3-ethoxy-4-phenylmethoxyphenyl)-4-ethyl-1,3-thiazole-5-carboxylic acid
CID 20993409
N,N-dimethyl-1-[3-(1,3-thiazol-2-yl)phenyl]methanamine
CID 173380030
azane;4-(1,3-thiazol-2-yl)phenol
CID 175575077
5-nitro-2-phenylmethoxy-N'-[1-[3-(1,3-thiazol-2-yl)phenyl]ethyl]benzohydrazide
CID 175027927

Frequently Asked Questions

What is the IUPAC name of 2-[3,4-bis(phenylmethoxy)phenyl]-1,3-thiazole?
The IUPAC name of 2-[3,4-bis(phenylmethoxy)phenyl]-1,3-thiazole (CID 25131159) is 2-[3,4-bis(phenylmethoxy)phenyl]-1,3-thiazole.
What is the SMILES notation for 2-[3,4-bis(phenylmethoxy)phenyl]-1,3-thiazole?
The canonical SMILES for 2-[3,4-bis(phenylmethoxy)phenyl]-1,3-thiazole is c1ccc(COc2ccc(-c3nccs3)cc2OCc2ccccc2)cc1.
What is the InChIKey of 2-[3,4-bis(phenylmethoxy)phenyl]-1,3-thiazole?
The InChIKey is HLZPNRFEWQMMSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19NO2S/c1-3-7-18(8-4-1)16-25-21-12-11-20(23-24-13-14-27-23)15-22(21)26-17-19-9-5-2-6-10-19/h1-15H,16-17H2.
What are the key properties of 2-[3,4-bis(phenylmethoxy)phenyl]-1,3-thiazole?
2-[3,4-bis(phenylmethoxy)phenyl]-1,3-thiazole has a molecular weight of 373.48 g/mol, XLogP of 5.97, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3,4-bis(phenylmethoxy)phenyl]-1,3-thiazole is sourced from PubChem (CID 25131159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).