(2S)-4-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl-2-(trifluoromethyl)morpholine

C10H9ClF3N3O3S2 — CID 95486479

IUPAC(2S)-4-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl-2-(trifluoromethyl)morpholine
SMILESO=S(=O)(c1c(Cl)nc2sccn12)N1CCO[C@H](C(F)(F)F)C1
InChIInChI=1S/C10H9ClF3N3O3S2/c11-7-8(17-2-4-21-9(17)15-7)22(18,19)16-1-3-20-6(5-16)10(12,13)14/h2,4,6H,1,3,5H2/t6-/m0/s1
InChIKeyJRTVQGCDHFAROP-LURJTMIESA-N
MW375.78 g/mol
LogP2.00
Rot. Bonds2

About (2S)-4-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl-2-(trifluoromethyl)morpholine

(2S)-4-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl-2-(trifluoromethyl)morpholine (PubChem CID 95486479) has the molecular formula C10H9ClF3N3O3S2 and a molecular weight of 375.78 g/mol. Its IUPAC name is (2S)-4-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl-2-(trifluoromethyl)morpholine.

Molecular Properties

Compound Name(2S)-4-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl-2-(trifluoromethyl)morpholine
PubChem CID95486479
Molecular FormulaC10H9ClF3N3O3S2
Molecular Weight375.78 g/mol
Exact Mass374.97
IUPAC Name(2S)-4-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl-2-(trifluoromethyl)morpholine
SMILESO=S(=O)(c1c(Cl)nc2sccn12)N1CCO[C@H](C(F)(F)F)C1
InChIInChI=1S/C10H9ClF3N3O3S2/c11-7-8(17-2-4-21-9(17)15-7)22(18,19)16-1-3-20-6(5-16)10(12,13)14/h2,4,6H,1,3,5H2/t6-/m0/s1
InChIKeyJRTVQGCDHFAROP-LURJTMIESA-N
XLogP2.00
TPSA63.91 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.78
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze (2S)-4-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl-2-(trifluoromethyl)morpholine 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 (2S)-4-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl-2-(trifluoromethyl)morpholine?
The IUPAC name of (2S)-4-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl-2-(trifluoromethyl)morpholine (CID 95486479) is (2S)-4-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl-2-(trifluoromethyl)morpholine.
What is the SMILES notation for (2S)-4-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl-2-(trifluoromethyl)morpholine?
The canonical SMILES for (2S)-4-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl-2-(trifluoromethyl)morpholine is O=S(=O)(c1c(Cl)nc2sccn12)N1CCO[C@H](C(F)(F)F)C1.
What is the InChIKey of (2S)-4-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl-2-(trifluoromethyl)morpholine?
The InChIKey is JRTVQGCDHFAROP-LURJTMIESA-N. The full InChI is InChI=1S/C10H9ClF3N3O3S2/c11-7-8(17-2-4-21-9(17)15-7)22(18,19)16-1-3-20-6(5-16)10(12,13)14/h2,4,6H,1,3,5H2/t6-/m0/s1.
What are the key properties of (2S)-4-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl-2-(trifluoromethyl)morpholine?
(2S)-4-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl-2-(trifluoromethyl)morpholine has a molecular weight of 375.78 g/mol, XLogP of 2.00, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-4-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl-2-(trifluoromethyl)morpholine is sourced from PubChem (CID 95486479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).