4-[5-(4-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol

C16H10N2O2S2 — CID 716380

IUPAC4-[5-(4-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol
SMILESOc1ccc(-c2nc3sc(-c4ccc(O)cc4)nc3s2)cc1
InChIInChI=1S/C16H10N2O2S2/c19-11-5-1-9(2-6-11)13-17-15-16(21-13)18-14(22-15)10-3-7-12(20)8-4-10/h1-8,19-20H
InChIKeySAIQMXKAQRSASU-UHFFFAOYSA-N
MW326.40 g/mol
LogP4.50
Rot. Bonds2

About 4-[5-(4-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol

4-[5-(4-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol (PubChem CID 716380) has the molecular formula C16H10N2O2S2 and a molecular weight of 326.40 g/mol. Its IUPAC name is 4-[5-(4-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol.

Molecular Properties

Compound Name4-[5-(4-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol
PubChem CID716380
Molecular FormulaC16H10N2O2S2
Molecular Weight326.40 g/mol
Exact Mass326.02
IUPAC Name4-[5-(4-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol
SMILESOc1ccc(-c2nc3sc(-c4ccc(O)cc4)nc3s2)cc1
InChIInChI=1S/C16H10N2O2S2/c19-11-5-1-9(2-6-11)13-17-15-16(21-13)18-14(22-15)10-3-7-12(20)8-4-10/h1-8,19-20H
InChIKeySAIQMXKAQRSASU-UHFFFAOYSA-N
XLogP4.50
TPSA66.24 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 54.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[5-(4-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol?
The IUPAC name of 4-[5-(4-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol (CID 716380) is 4-[5-(4-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol.
What is the SMILES notation for 4-[5-(4-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol?
The canonical SMILES for 4-[5-(4-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol is Oc1ccc(-c2nc3sc(-c4ccc(O)cc4)nc3s2)cc1.
What is the InChIKey of 4-[5-(4-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol?
The InChIKey is SAIQMXKAQRSASU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10N2O2S2/c19-11-5-1-9(2-6-11)13-17-15-16(21-13)18-14(22-15)10-3-7-12(20)8-4-10/h1-8,19-20H.
What are the key properties of 4-[5-(4-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol?
4-[5-(4-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol has a molecular weight of 326.40 g/mol, XLogP of 4.50, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(4-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol is sourced from PubChem (CID 716380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).