2-(4-ethoxy-3-morpholin-4-ylsulfonylphenyl)thiazinane 1,1-dioxide

C16H24N2O6S2 — CID 39776409

IUPAC2-(4-ethoxy-3-morpholin-4-ylsulfonylphenyl)thiazinane 1,1-dioxide
SMILESCCOc1ccc(N2CCCCS2(=O)=O)cc1S(=O)(=O)N1CCOCC1
InChIInChI=1S/C16H24N2O6S2/c1-2-24-15-6-5-14(18-7-3-4-12-25(18,19)20)13-16(15)26(21,22)17-8-10-23-11-9-17/h5-6,13H,2-4,7-12H2,1H3
InChIKeyBDZXRXPSBPPGHM-UHFFFAOYSA-N
MW404.51 g/mol
LogP1.04
Rot. Bonds5

About 2-(4-ethoxy-3-morpholin-4-ylsulfonylphenyl)thiazinane 1,1-dioxide

2-(4-ethoxy-3-morpholin-4-ylsulfonylphenyl)thiazinane 1,1-dioxide (PubChem CID 39776409) has the molecular formula C16H24N2O6S2 and a molecular weight of 404.51 g/mol. Its IUPAC name is 2-(4-ethoxy-3-morpholin-4-ylsulfonylphenyl)thiazinane 1,1-dioxide.

Molecular Properties

Compound Name2-(4-ethoxy-3-morpholin-4-ylsulfonylphenyl)thiazinane 1,1-dioxide
PubChem CID39776409
Molecular FormulaC16H24N2O6S2
Molecular Weight404.51 g/mol
Exact Mass404.11
IUPAC Name2-(4-ethoxy-3-morpholin-4-ylsulfonylphenyl)thiazinane 1,1-dioxide
SMILESCCOc1ccc(N2CCCCS2(=O)=O)cc1S(=O)(=O)N1CCOCC1
InChIInChI=1S/C16H24N2O6S2/c1-2-24-15-6-5-14(18-7-3-4-12-25(18,19)20)13-16(15)26(21,22)17-8-10-23-11-9-17/h5-6,13H,2-4,7-12H2,1H3
InChIKeyBDZXRXPSBPPGHM-UHFFFAOYSA-N
XLogP1.04
TPSA93.22 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.51
LogP ≤ 51.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-(4-ethoxy-3-morpholin-4-ylsulfonylphenyl)thiazinane 1,1-dioxide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2,6-diethylphenyl)-5-(1,1-dioxothiazinan-2-yl)-2-ethoxybenzenesulfonamide
CID 39776514
N-butan-2-yl-5-(1,1-dioxothiazinan-2-yl)-2-ethoxybenzenesulfonamide
CID 46307101
N-cyclohexyl-5-(1,1-dioxothiazinan-2-yl)-2-ethoxybenzenesulfonamide
CID 39776404
5-(1,1-dioxothiazinan-2-yl)-2-ethoxy-N-(4-methylphenyl)benzenesulfonamide
CID 39776497
5-(1,1-dioxothiazinan-2-yl)-2-ethoxy-N-(2-methoxyethyl)benzenesulfonamide
CID 39776407
2-(4-morpholin-4-ylsulfonylphenyl)thiazinane 1,1-dioxide
CID 7216463
N-(2,3-dimethylphenyl)-5-(1,1-dioxothiazinan-2-yl)-2-ethoxybenzenesulfonamide
CID 39776506
2-(4-ethoxy-3-morpholin-4-ylsulfonylphenyl)butanoyl chloride
CID 22994156
3-amino-N-(4-ethoxy-3-morpholin-4-ylsulfonylphenyl)cyclopentane-1-carboxamide
CID 119693225
(2S)-2-amino-N-(4-ethoxy-3-morpholin-4-ylsulfonylphenyl)-4-methylpentanamide
CID 119693241
N-(4-ethoxy-3-morpholin-4-ylsulfonylphenyl)-3,5-dimethyl-1,2-oxazole-4-carboxamide
CID 9050102
N-(4-ethoxy-3-morpholin-4-ylsulfonylphenyl)-2-methyl-2-phenylpropanamide
CID 46532531

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxy-3-morpholin-4-ylsulfonylphenyl)thiazinane 1,1-dioxide?
The IUPAC name of 2-(4-ethoxy-3-morpholin-4-ylsulfonylphenyl)thiazinane 1,1-dioxide (CID 39776409) is 2-(4-ethoxy-3-morpholin-4-ylsulfonylphenyl)thiazinane 1,1-dioxide.
What is the SMILES notation for 2-(4-ethoxy-3-morpholin-4-ylsulfonylphenyl)thiazinane 1,1-dioxide?
The canonical SMILES for 2-(4-ethoxy-3-morpholin-4-ylsulfonylphenyl)thiazinane 1,1-dioxide is CCOc1ccc(N2CCCCS2(=O)=O)cc1S(=O)(=O)N1CCOCC1.
What is the InChIKey of 2-(4-ethoxy-3-morpholin-4-ylsulfonylphenyl)thiazinane 1,1-dioxide?
The InChIKey is BDZXRXPSBPPGHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O6S2/c1-2-24-15-6-5-14(18-7-3-4-12-25(18,19)20)13-16(15)26(21,22)17-8-10-23-11-9-17/h5-6,13H,2-4,7-12H2,1H3.
What are the key properties of 2-(4-ethoxy-3-morpholin-4-ylsulfonylphenyl)thiazinane 1,1-dioxide?
2-(4-ethoxy-3-morpholin-4-ylsulfonylphenyl)thiazinane 1,1-dioxide has a molecular weight of 404.51 g/mol, XLogP of 1.04, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxy-3-morpholin-4-ylsulfonylphenyl)thiazinane 1,1-dioxide is sourced from PubChem (CID 39776409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).