5-(4-chlorophenyl)-4-methyl-3-morpholin-4-yl-1,2-thiazole 1,1-dioxide

C14H15ClN2O3S — CID 22512112

IUPAC5-(4-chlorophenyl)-4-methyl-3-morpholin-4-yl-1,2-thiazole 1,1-dioxide
SMILESCC1=C(c2ccc(Cl)cc2)S(=O)(=O)N=C1N1CCOCC1
InChIInChI=1S/C14H15ClN2O3S/c1-10-13(11-2-4-12(15)5-3-11)21(18,19)16-14(10)17-6-8-20-9-7-17/h2-5H,6-9H2,1H3
InChIKeyWGSXAYSXAPOZGS-UHFFFAOYSA-N
MW326.81 g/mol
LogP2.15
Rot. Bonds1

About 5-(4-chlorophenyl)-4-methyl-3-morpholin-4-yl-1,2-thiazole 1,1-dioxide

5-(4-chlorophenyl)-4-methyl-3-morpholin-4-yl-1,2-thiazole 1,1-dioxide (PubChem CID 22512112) has the molecular formula C14H15ClN2O3S and a molecular weight of 326.81 g/mol. Its IUPAC name is 5-(4-chlorophenyl)-4-methyl-3-morpholin-4-yl-1,2-thiazole 1,1-dioxide.

Molecular Properties

Compound Name5-(4-chlorophenyl)-4-methyl-3-morpholin-4-yl-1,2-thiazole 1,1-dioxide
PubChem CID22512112
Molecular FormulaC14H15ClN2O3S
Molecular Weight326.81 g/mol
Exact Mass326.05
IUPAC Name5-(4-chlorophenyl)-4-methyl-3-morpholin-4-yl-1,2-thiazole 1,1-dioxide
SMILESCC1=C(c2ccc(Cl)cc2)S(=O)(=O)N=C1N1CCOCC1
InChIInChI=1S/C14H15ClN2O3S/c1-10-13(11-2-4-12(15)5-3-11)21(18,19)16-14(10)17-6-8-20-9-7-17/h2-5H,6-9H2,1H3
InChIKeyWGSXAYSXAPOZGS-UHFFFAOYSA-N
XLogP2.15
TPSA58.97 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.81
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-(4-chlorophenyl)-4-methyl-3-morpholin-4-yl-1,2-thiazole 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

Frequently Asked Questions

What is the IUPAC name of 5-(4-chlorophenyl)-4-methyl-3-morpholin-4-yl-1,2-thiazole 1,1-dioxide?
The IUPAC name of 5-(4-chlorophenyl)-4-methyl-3-morpholin-4-yl-1,2-thiazole 1,1-dioxide (CID 22512112) is 5-(4-chlorophenyl)-4-methyl-3-morpholin-4-yl-1,2-thiazole 1,1-dioxide.
What is the SMILES notation for 5-(4-chlorophenyl)-4-methyl-3-morpholin-4-yl-1,2-thiazole 1,1-dioxide?
The canonical SMILES for 5-(4-chlorophenyl)-4-methyl-3-morpholin-4-yl-1,2-thiazole 1,1-dioxide is CC1=C(c2ccc(Cl)cc2)S(=O)(=O)N=C1N1CCOCC1.
What is the InChIKey of 5-(4-chlorophenyl)-4-methyl-3-morpholin-4-yl-1,2-thiazole 1,1-dioxide?
The InChIKey is WGSXAYSXAPOZGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O3S/c1-10-13(11-2-4-12(15)5-3-11)21(18,19)16-14(10)17-6-8-20-9-7-17/h2-5H,6-9H2,1H3.
What are the key properties of 5-(4-chlorophenyl)-4-methyl-3-morpholin-4-yl-1,2-thiazole 1,1-dioxide?
5-(4-chlorophenyl)-4-methyl-3-morpholin-4-yl-1,2-thiazole 1,1-dioxide has a molecular weight of 326.81 g/mol, XLogP of 2.15, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chlorophenyl)-4-methyl-3-morpholin-4-yl-1,2-thiazole 1,1-dioxide is sourced from PubChem (CID 22512112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).