2-(2-methoxyethyl)-3-methyl-1,1-dioxo-3,4-dihydrothieno[3,2-e]thiazine-6-sulfonamide

C10H16N2O5S3 — CID 22901910

IUPAC2-(2-methoxyethyl)-3-methyl-1,1-dioxo-3,4-dihydrothieno[3,2-e]thiazine-6-sulfonamide
SMILESCOCCN1C(C)Cc2cc(S(N)(=O)=O)sc2S1(=O)=O
InChIInChI=1S/C10H16N2O5S3/c1-7-5-8-6-9(19(11,13)14)18-10(8)20(15,16)12(7)3-4-17-2/h6-7H,3-5H2,1-2H3,(H2,11,13,14)
InChIKeyRQHFQKUJCBGAJK-UHFFFAOYSA-N
MW340.45 g/mol
LogP-0.02
Rot. Bonds4

About 2-(2-methoxyethyl)-3-methyl-1,1-dioxo-3,4-dihydrothieno[3,2-e]thiazine-6-sulfonamide

2-(2-methoxyethyl)-3-methyl-1,1-dioxo-3,4-dihydrothieno[3,2-e]thiazine-6-sulfonamide (PubChem CID 22901910) has the molecular formula C10H16N2O5S3 and a molecular weight of 340.45 g/mol. Its IUPAC name is 2-(2-methoxyethyl)-3-methyl-1,1-dioxo-3,4-dihydrothieno[3,2-e]thiazine-6-sulfonamide.

Molecular Properties

Compound Name2-(2-methoxyethyl)-3-methyl-1,1-dioxo-3,4-dihydrothieno[3,2-e]thiazine-6-sulfonamide
PubChem CID22901910
Molecular FormulaC10H16N2O5S3
Molecular Weight340.45 g/mol
Exact Mass340.02
IUPAC Name2-(2-methoxyethyl)-3-methyl-1,1-dioxo-3,4-dihydrothieno[3,2-e]thiazine-6-sulfonamide
SMILESCOCCN1C(C)Cc2cc(S(N)(=O)=O)sc2S1(=O)=O
InChIInChI=1S/C10H16N2O5S3/c1-7-5-8-6-9(19(11,13)14)18-10(8)20(15,16)12(7)3-4-17-2/h6-7H,3-5H2,1-2H3,(H2,11,13,14)
InChIKeyRQHFQKUJCBGAJK-UHFFFAOYSA-N
XLogP-0.02
TPSA106.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.45
LogP ≤ 5-0.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethyl)-3-methyl-1,1-dioxo-3,4-dihydrothieno[3,2-e]thiazine-6-sulfonamide?
The IUPAC name of 2-(2-methoxyethyl)-3-methyl-1,1-dioxo-3,4-dihydrothieno[3,2-e]thiazine-6-sulfonamide (CID 22901910) is 2-(2-methoxyethyl)-3-methyl-1,1-dioxo-3,4-dihydrothieno[3,2-e]thiazine-6-sulfonamide.
What is the SMILES notation for 2-(2-methoxyethyl)-3-methyl-1,1-dioxo-3,4-dihydrothieno[3,2-e]thiazine-6-sulfonamide?
The canonical SMILES for 2-(2-methoxyethyl)-3-methyl-1,1-dioxo-3,4-dihydrothieno[3,2-e]thiazine-6-sulfonamide is COCCN1C(C)Cc2cc(S(N)(=O)=O)sc2S1(=O)=O.
What is the InChIKey of 2-(2-methoxyethyl)-3-methyl-1,1-dioxo-3,4-dihydrothieno[3,2-e]thiazine-6-sulfonamide?
The InChIKey is RQHFQKUJCBGAJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O5S3/c1-7-5-8-6-9(19(11,13)14)18-10(8)20(15,16)12(7)3-4-17-2/h6-7H,3-5H2,1-2H3,(H2,11,13,14).
What are the key properties of 2-(2-methoxyethyl)-3-methyl-1,1-dioxo-3,4-dihydrothieno[3,2-e]thiazine-6-sulfonamide?
2-(2-methoxyethyl)-3-methyl-1,1-dioxo-3,4-dihydrothieno[3,2-e]thiazine-6-sulfonamide has a molecular weight of 340.45 g/mol, XLogP of -0.02, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethyl)-3-methyl-1,1-dioxo-3,4-dihydrothieno[3,2-e]thiazine-6-sulfonamide is sourced from PubChem (CID 22901910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).