(1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-yl)-morpholin-4-ylmethanone

C16H17N3O4S — CID 50749892

IUPAC(1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-yl)-morpholin-4-ylmethanone
SMILESO=C(c1c(-c2ccccc2)nc2n1CCS2(=O)=O)N1CCOCC1
InChIInChI=1S/C16H17N3O4S/c20-15(18-6-9-23-10-7-18)14-13(12-4-2-1-3-5-12)17-16-19(14)8-11-24(16,21)22/h1-5H,6-11H2
InChIKeyDFBOAGFTHSGCAL-UHFFFAOYSA-N
MW347.40 g/mol
LogP0.81
Rot. Bonds2

About (1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-yl)-morpholin-4-ylmethanone

(1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-yl)-morpholin-4-ylmethanone (PubChem CID 50749892) has the molecular formula C16H17N3O4S and a molecular weight of 347.40 g/mol. Its IUPAC name is (1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-yl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-yl)-morpholin-4-ylmethanone
PubChem CID50749892
Molecular FormulaC16H17N3O4S
Molecular Weight347.40 g/mol
Exact Mass347.09
IUPAC Name(1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-yl)-morpholin-4-ylmethanone
SMILESO=C(c1c(-c2ccccc2)nc2n1CCS2(=O)=O)N1CCOCC1
InChIInChI=1S/C16H17N3O4S/c20-15(18-6-9-23-10-7-18)14-13(12-4-2-1-3-5-12)17-16-19(14)8-11-24(16,21)22/h1-5H,6-11H2
InChIKeyDFBOAGFTHSGCAL-UHFFFAOYSA-N
XLogP0.81
TPSA81.50 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.40
LogP ≤ 50.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-yl)-morpholin-4-ylmethanone?
The IUPAC name of (1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-yl)-morpholin-4-ylmethanone (CID 50749892) is (1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-yl)-morpholin-4-ylmethanone.
What is the SMILES notation for (1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-yl)-morpholin-4-ylmethanone?
The canonical SMILES for (1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-yl)-morpholin-4-ylmethanone is O=C(c1c(-c2ccccc2)nc2n1CCS2(=O)=O)N1CCOCC1.
What is the InChIKey of (1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-yl)-morpholin-4-ylmethanone?
The InChIKey is DFBOAGFTHSGCAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O4S/c20-15(18-6-9-23-10-7-18)14-13(12-4-2-1-3-5-12)17-16-19(14)8-11-24(16,21)22/h1-5H,6-11H2.
What are the key properties of (1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-yl)-morpholin-4-ylmethanone?
(1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-yl)-morpholin-4-ylmethanone has a molecular weight of 347.40 g/mol, XLogP of 0.81, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-yl)-morpholin-4-ylmethanone is sourced from PubChem (CID 50749892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).