2-(6-chloro-4H-indeno[1,2-d][1,3]thiazol-2-yl)phenol

C16H10ClNOS — CID 135418365

IUPAC2-(6-chloro-4H-indeno[1,2-d][1,3]thiazol-2-yl)phenol
SMILESOc1ccccc1-c1nc2c(s1)Cc1cc(Cl)ccc1-2
InChIInChI=1S/C16H10ClNOS/c17-10-5-6-11-9(7-10)8-14-15(11)18-16(20-14)12-3-1-2-4-13(12)19/h1-7,19H,8H2
InChIKeyKOVLQXGYASFBFS-UHFFFAOYSA-N
MW299.78 g/mol
LogP4.74
Rot. Bonds1

About 2-(6-chloro-4H-indeno[1,2-d][1,3]thiazol-2-yl)phenol

2-(6-chloro-4H-indeno[1,2-d][1,3]thiazol-2-yl)phenol (PubChem CID 135418365) has the molecular formula C16H10ClNOS and a molecular weight of 299.78 g/mol. Its IUPAC name is 2-(6-chloro-4H-indeno[1,2-d][1,3]thiazol-2-yl)phenol.

Molecular Properties

Compound Name2-(6-chloro-4H-indeno[1,2-d][1,3]thiazol-2-yl)phenol
PubChem CID135418365
Molecular FormulaC16H10ClNOS
Molecular Weight299.78 g/mol
Exact Mass299.02
IUPAC Name2-(6-chloro-4H-indeno[1,2-d][1,3]thiazol-2-yl)phenol
SMILESOc1ccccc1-c1nc2c(s1)Cc1cc(Cl)ccc1-2
InChIInChI=1S/C16H10ClNOS/c17-10-5-6-11-9(7-10)8-14-15(11)18-16(20-14)12-3-1-2-4-13(12)19/h1-7,19H,8H2
InChIKeyKOVLQXGYASFBFS-UHFFFAOYSA-N
XLogP4.74
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.78
LogP ≤ 54.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(6-chloro-4H-indeno[1,2-d][1,3]thiazol-2-yl)phenol?
The IUPAC name of 2-(6-chloro-4H-indeno[1,2-d][1,3]thiazol-2-yl)phenol (CID 135418365) is 2-(6-chloro-4H-indeno[1,2-d][1,3]thiazol-2-yl)phenol.
What is the SMILES notation for 2-(6-chloro-4H-indeno[1,2-d][1,3]thiazol-2-yl)phenol?
The canonical SMILES for 2-(6-chloro-4H-indeno[1,2-d][1,3]thiazol-2-yl)phenol is Oc1ccccc1-c1nc2c(s1)Cc1cc(Cl)ccc1-2.
What is the InChIKey of 2-(6-chloro-4H-indeno[1,2-d][1,3]thiazol-2-yl)phenol?
The InChIKey is KOVLQXGYASFBFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10ClNOS/c17-10-5-6-11-9(7-10)8-14-15(11)18-16(20-14)12-3-1-2-4-13(12)19/h1-7,19H,8H2.
What are the key properties of 2-(6-chloro-4H-indeno[1,2-d][1,3]thiazol-2-yl)phenol?
2-(6-chloro-4H-indeno[1,2-d][1,3]thiazol-2-yl)phenol has a molecular weight of 299.78 g/mol, XLogP of 4.74, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-chloro-4H-indeno[1,2-d][1,3]thiazol-2-yl)phenol is sourced from PubChem (CID 135418365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).