5-chloro-4-hydroxy-2-phenyl-1,3-thiazin-6-one

C10H6ClNO2S — CID 135422860

IUPAC5-chloro-4-hydroxy-2-phenyl-1,3-thiazin-6-one
SMILESO=c1sc(-c2ccccc2)nc(O)c1Cl
InChIInChI=1S/C10H6ClNO2S/c11-7-8(13)12-9(15-10(7)14)6-4-2-1-3-5-6/h1-5,13H
InChIKeyPKVZJZKOVPZBDV-UHFFFAOYSA-N
MW239.68 g/mol
LogP2.53
Rot. Bonds1

About 5-chloro-4-hydroxy-2-phenyl-1,3-thiazin-6-one

5-chloro-4-hydroxy-2-phenyl-1,3-thiazin-6-one (PubChem CID 135422860) has the molecular formula C10H6ClNO2S and a molecular weight of 239.68 g/mol. Its IUPAC name is 5-chloro-4-hydroxy-2-phenyl-1,3-thiazin-6-one.

Molecular Properties

Compound Name5-chloro-4-hydroxy-2-phenyl-1,3-thiazin-6-one
PubChem CID135422860
Molecular FormulaC10H6ClNO2S
Molecular Weight239.68 g/mol
Exact Mass238.98
IUPAC Name5-chloro-4-hydroxy-2-phenyl-1,3-thiazin-6-one
SMILESO=c1sc(-c2ccccc2)nc(O)c1Cl
InChIInChI=1S/C10H6ClNO2S/c11-7-8(13)12-9(15-10(7)14)6-4-2-1-3-5-6/h1-5,13H
InChIKeyPKVZJZKOVPZBDV-UHFFFAOYSA-N
XLogP2.53
TPSA50.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.68
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1,3-Thiazine-6-one-4-ol, 2-phenyl-
CID 135425122
1,3-Thiazine-6-one-4-ol, 2-(4-chlorophenyl)-
CID 135418574
4-Chloro-2-phenyl-6h-1,3-thiazin-6-one
CID 13317403
6-Oxo-2-phenyl-5-formyl-4-chloro-1,3-thiazine
CID 13317409
Sodium 2-phenyl-6-oxo-6h-1,3-thiazine-4-thiolate
CID 129764547
4-Sulfanyl-2-phenyl-6h-1,3-thiazin-6-one
CID 129764548
4-Fluoro-2-phenyl-1,3-thiazin-6-one
CID 13317412
5-Chloro-2-(4-fluorophenyl)-4-hydroxy-1,3-thiazin-6-one
CID 135542491
2-(3-Chloro-4-fluorophenyl)-4-hydroxy-1,3-thiazin-6-one
CID 135837091
4-hydroxy-2-[4-(propan-2-yl)phenyl]-6H-1,3-thiazin-6-one
CID 135534062
4-Methoxy-2-phenyl-1,3-thiazin-6-one
CID 7315325
2-Phenyl-1,3-thiazin-6-one
CID 12246048

Frequently Asked Questions

What is the IUPAC name of 5-chloro-4-hydroxy-2-phenyl-1,3-thiazin-6-one?
The IUPAC name of 5-chloro-4-hydroxy-2-phenyl-1,3-thiazin-6-one (CID 135422860) is 5-chloro-4-hydroxy-2-phenyl-1,3-thiazin-6-one.
What is the SMILES notation for 5-chloro-4-hydroxy-2-phenyl-1,3-thiazin-6-one?
The canonical SMILES for 5-chloro-4-hydroxy-2-phenyl-1,3-thiazin-6-one is O=c1sc(-c2ccccc2)nc(O)c1Cl.
What is the InChIKey of 5-chloro-4-hydroxy-2-phenyl-1,3-thiazin-6-one?
The InChIKey is PKVZJZKOVPZBDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6ClNO2S/c11-7-8(13)12-9(15-10(7)14)6-4-2-1-3-5-6/h1-5,13H.
What are the key properties of 5-chloro-4-hydroxy-2-phenyl-1,3-thiazin-6-one?
5-chloro-4-hydroxy-2-phenyl-1,3-thiazin-6-one has a molecular weight of 239.68 g/mol, XLogP of 2.53, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-4-hydroxy-2-phenyl-1,3-thiazin-6-one is sourced from PubChem (CID 135422860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).