(10-methyl-5-oxophenothiazin-3-yl)methanol

C14H13NO2S — CID 11482338

IUPAC(10-methyl-5-oxophenothiazin-3-yl)methanol
SMILESCN1c2ccccc2S(=O)c2cc(CO)ccc21
InChIInChI=1S/C14H13NO2S/c1-15-11-4-2-3-5-13(11)18(17)14-8-10(9-16)6-7-12(14)15/h2-8,16H,9H2,1H3
InChIKeyMNOBPISRZSEHOC-UHFFFAOYSA-N
MW259.33 g/mol
LogP2.43
Rot. Bonds1

About (10-methyl-5-oxophenothiazin-3-yl)methanol

(10-methyl-5-oxophenothiazin-3-yl)methanol (PubChem CID 11482338) has the molecular formula C14H13NO2S and a molecular weight of 259.33 g/mol. Its IUPAC name is (10-methyl-5-oxophenothiazin-3-yl)methanol.

Molecular Properties

Compound Name(10-methyl-5-oxophenothiazin-3-yl)methanol
PubChem CID11482338
Molecular FormulaC14H13NO2S
Molecular Weight259.33 g/mol
Exact Mass259.07
IUPAC Name(10-methyl-5-oxophenothiazin-3-yl)methanol
SMILESCN1c2ccccc2S(=O)c2cc(CO)ccc21
InChIInChI=1S/C14H13NO2S/c1-15-11-4-2-3-5-13(11)18(17)14-8-10(9-16)6-7-12(14)15/h2-8,16H,9H2,1H3
InChIKeyMNOBPISRZSEHOC-UHFFFAOYSA-N
XLogP2.43
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.33
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (10-methyl-5-oxophenothiazin-3-yl)methanol?
The IUPAC name of (10-methyl-5-oxophenothiazin-3-yl)methanol (CID 11482338) is (10-methyl-5-oxophenothiazin-3-yl)methanol.
What is the SMILES notation for (10-methyl-5-oxophenothiazin-3-yl)methanol?
The canonical SMILES for (10-methyl-5-oxophenothiazin-3-yl)methanol is CN1c2ccccc2S(=O)c2cc(CO)ccc21.
What is the InChIKey of (10-methyl-5-oxophenothiazin-3-yl)methanol?
The InChIKey is MNOBPISRZSEHOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO2S/c1-15-11-4-2-3-5-13(11)18(17)14-8-10(9-16)6-7-12(14)15/h2-8,16H,9H2,1H3.
What are the key properties of (10-methyl-5-oxophenothiazin-3-yl)methanol?
(10-methyl-5-oxophenothiazin-3-yl)methanol has a molecular weight of 259.33 g/mol, XLogP of 2.43, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (10-methyl-5-oxophenothiazin-3-yl)methanol is sourced from PubChem (CID 11482338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).