N-(4,5-dihydro-1,3-thiazol-2-yl)-1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazole-5-carboxamide

C15H14N4O3S2 — CID 50749615

IUPACN-(4,5-dihydro-1,3-thiazol-2-yl)-1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazole-5-carboxamide
SMILESO=C(NC1=NCCS1)c1c(-c2ccccc2)nc2n1CCS2(=O)=O
InChIInChI=1S/C15H14N4O3S2/c20-13(18-14-16-6-8-23-14)12-11(10-4-2-1-3-5-10)17-15-19(12)7-9-24(15,21)22/h1-5H,6-9H2,(H,16,18,20)
InChIKeyOZDYDBWFXIPADH-UHFFFAOYSA-N
MW362.44 g/mol
LogP1.17
Rot. Bonds2

About N-(4,5-dihydro-1,3-thiazol-2-yl)-1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazole-5-carboxamide

N-(4,5-dihydro-1,3-thiazol-2-yl)-1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazole-5-carboxamide (PubChem CID 50749615) has the molecular formula C15H14N4O3S2 and a molecular weight of 362.44 g/mol. Its IUPAC name is N-(4,5-dihydro-1,3-thiazol-2-yl)-1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazole-5-carboxamide.

Molecular Properties

Compound NameN-(4,5-dihydro-1,3-thiazol-2-yl)-1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazole-5-carboxamide
PubChem CID50749615
Molecular FormulaC15H14N4O3S2
Molecular Weight362.44 g/mol
Exact Mass362.05
IUPAC NameN-(4,5-dihydro-1,3-thiazol-2-yl)-1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazole-5-carboxamide
SMILESO=C(NC1=NCCS1)c1c(-c2ccccc2)nc2n1CCS2(=O)=O
InChIInChI=1S/C15H14N4O3S2/c20-13(18-14-16-6-8-23-14)12-11(10-4-2-1-3-5-10)17-15-19(12)7-9-24(15,21)22/h1-5H,6-9H2,(H,16,18,20)
InChIKeyOZDYDBWFXIPADH-UHFFFAOYSA-N
XLogP1.17
TPSA93.42 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.44
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-(4,5-dihydro-1,3-thiazol-2-yl)-1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazole-5-carboxamide?
The IUPAC name of N-(4,5-dihydro-1,3-thiazol-2-yl)-1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazole-5-carboxamide (CID 50749615) is N-(4,5-dihydro-1,3-thiazol-2-yl)-1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazole-5-carboxamide.
What is the SMILES notation for N-(4,5-dihydro-1,3-thiazol-2-yl)-1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazole-5-carboxamide?
The canonical SMILES for N-(4,5-dihydro-1,3-thiazol-2-yl)-1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazole-5-carboxamide is O=C(NC1=NCCS1)c1c(-c2ccccc2)nc2n1CCS2(=O)=O.
What is the InChIKey of N-(4,5-dihydro-1,3-thiazol-2-yl)-1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazole-5-carboxamide?
The InChIKey is OZDYDBWFXIPADH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O3S2/c20-13(18-14-16-6-8-23-14)12-11(10-4-2-1-3-5-10)17-15-19(12)7-9-24(15,21)22/h1-5H,6-9H2,(H,16,18,20).
What are the key properties of N-(4,5-dihydro-1,3-thiazol-2-yl)-1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazole-5-carboxamide?
N-(4,5-dihydro-1,3-thiazol-2-yl)-1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazole-5-carboxamide has a molecular weight of 362.44 g/mol, XLogP of 1.17, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dihydro-1,3-thiazol-2-yl)-1,1-dioxo-6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazole-5-carboxamide is sourced from PubChem (CID 50749615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).