10H-phenothiazin-3-yl carbamate

C13H10N2O2S — CID 121452035

IUPAC10H-phenothiazin-3-yl carbamate
SMILESNC(=O)Oc1ccc2c(c1)Sc1ccccc1N2
InChIInChI=1S/C13H10N2O2S/c14-13(16)17-8-5-6-10-12(7-8)18-11-4-2-1-3-9(11)15-10/h1-7,15H,(H2,14,16)
InChIKeyIQWZLIASCLWMAK-UHFFFAOYSA-N
MW258.30 g/mol
LogP3.35
Rot. Bonds1

About 10H-phenothiazin-3-yl carbamate

10H-phenothiazin-3-yl carbamate (PubChem CID 121452035) has the molecular formula C13H10N2O2S and a molecular weight of 258.30 g/mol. Its IUPAC name is 10H-phenothiazin-3-yl carbamate.

Molecular Properties

Compound Name10H-phenothiazin-3-yl carbamate
PubChem CID121452035
Molecular FormulaC13H10N2O2S
Molecular Weight258.30 g/mol
Exact Mass258.05
IUPAC Name10H-phenothiazin-3-yl carbamate
SMILESNC(=O)Oc1ccc2c(c1)Sc1ccccc1N2
InChIInChI=1S/C13H10N2O2S/c14-13(16)17-8-5-6-10-12(7-8)18-11-4-2-1-3-9(11)15-10/h1-7,15H,(H2,14,16)
InChIKeyIQWZLIASCLWMAK-UHFFFAOYSA-N
XLogP3.35
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.30
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 10H-phenothiazin-3-yl carbamate?
The IUPAC name of 10H-phenothiazin-3-yl carbamate (CID 121452035) is 10H-phenothiazin-3-yl carbamate.
What is the SMILES notation for 10H-phenothiazin-3-yl carbamate?
The canonical SMILES for 10H-phenothiazin-3-yl carbamate is NC(=O)Oc1ccc2c(c1)Sc1ccccc1N2.
What is the InChIKey of 10H-phenothiazin-3-yl carbamate?
The InChIKey is IQWZLIASCLWMAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N2O2S/c14-13(16)17-8-5-6-10-12(7-8)18-11-4-2-1-3-9(11)15-10/h1-7,15H,(H2,14,16).
What are the key properties of 10H-phenothiazin-3-yl carbamate?
10H-phenothiazin-3-yl carbamate has a molecular weight of 258.30 g/mol, XLogP of 3.35, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 10H-phenothiazin-3-yl carbamate is sourced from PubChem (CID 121452035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).