N-[2-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]benzamide

C18H15N3OS — CID 121148230

IUPACN-[2-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]benzamide
SMILESO=C(Nc1ccccc1-c1cn2c(n1)SCC2)c1ccccc1
InChIInChI=1S/C18H15N3OS/c22-17(13-6-2-1-3-7-13)19-15-9-5-4-8-14(15)16-12-21-10-11-23-18(21)20-16/h1-9,12H,10-11H2,(H,19,22)
InChIKeySPRPHGZGNVVLNU-UHFFFAOYSA-N
MW321.41 g/mol
LogP3.91
Rot. Bonds3

About N-[2-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]benzamide

N-[2-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]benzamide (PubChem CID 121148230) has the molecular formula C18H15N3OS and a molecular weight of 321.41 g/mol. Its IUPAC name is N-[2-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]benzamide.

Molecular Properties

Compound NameN-[2-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]benzamide
PubChem CID121148230
Molecular FormulaC18H15N3OS
Molecular Weight321.41 g/mol
Exact Mass321.09
IUPAC NameN-[2-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]benzamide
SMILESO=C(Nc1ccccc1-c1cn2c(n1)SCC2)c1ccccc1
InChIInChI=1S/C18H15N3OS/c22-17(13-6-2-1-3-7-13)19-15-9-5-4-8-14(15)16-12-21-10-11-23-18(21)20-16/h1-9,12H,10-11H2,(H,19,22)
InChIKeySPRPHGZGNVVLNU-UHFFFAOYSA-N
XLogP3.91
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.41
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]benzamide?
The IUPAC name of N-[2-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]benzamide (CID 121148230) is N-[2-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]benzamide.
What is the SMILES notation for N-[2-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]benzamide?
The canonical SMILES for N-[2-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]benzamide is O=C(Nc1ccccc1-c1cn2c(n1)SCC2)c1ccccc1.
What is the InChIKey of N-[2-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]benzamide?
The InChIKey is SPRPHGZGNVVLNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3OS/c22-17(13-6-2-1-3-7-13)19-15-9-5-4-8-14(15)16-12-21-10-11-23-18(21)20-16/h1-9,12H,10-11H2,(H,19,22).
What are the key properties of N-[2-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]benzamide?
N-[2-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]benzamide has a molecular weight of 321.41 g/mol, XLogP of 3.91, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]benzamide is sourced from PubChem (CID 121148230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).