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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Related Compounds

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CID 136995857
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CID 54374082
CID 54374082
CID 67589970
CID 67589970
CID 135418318
CID 135418318
CID 139886189
CID 139886189
CID 141824216
CID 141824216
CID 28942277
CID 28942277
CID 28942285
CID 28942285
CID 28942293
CID 28942293
CID 81694016
CID 81694016

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).