2-methoxy-4-[5-(3-methylanilino)imidazo[2,1-b][1,3]thiazol-6-yl]phenol

C19H17N3O2S — CID 7066893

IUPAC2-methoxy-4-[5-(3-methylanilino)imidazo[2,1-b][1,3]thiazol-6-yl]phenol
SMILESCOc1cc(-c2nc3sccn3c2Nc2cccc(C)c2)ccc1O
InChIInChI=1S/C19H17N3O2S/c1-12-4-3-5-14(10-12)20-18-17(21-19-22(18)8-9-25-19)13-6-7-15(23)16(11-13)24-2/h3-11,20,23H,1-2H3
InChIKeyIZZVZRWZANPYSE-UHFFFAOYSA-N
MW351.43 g/mol
LogP4.83
Rot. Bonds4

About 2-methoxy-4-[5-(3-methylanilino)imidazo[2,1-b][1,3]thiazol-6-yl]phenol

2-methoxy-4-[5-(3-methylanilino)imidazo[2,1-b][1,3]thiazol-6-yl]phenol (PubChem CID 7066893) has the molecular formula C19H17N3O2S and a molecular weight of 351.43 g/mol. Its IUPAC name is 2-methoxy-4-[5-(3-methylanilino)imidazo[2,1-b][1,3]thiazol-6-yl]phenol.

Molecular Properties

Compound Name2-methoxy-4-[5-(3-methylanilino)imidazo[2,1-b][1,3]thiazol-6-yl]phenol
PubChem CID7066893
Molecular FormulaC19H17N3O2S
Molecular Weight351.43 g/mol
Exact Mass351.10
IUPAC Name2-methoxy-4-[5-(3-methylanilino)imidazo[2,1-b][1,3]thiazol-6-yl]phenol
SMILESCOc1cc(-c2nc3sccn3c2Nc2cccc(C)c2)ccc1O
InChIInChI=1S/C19H17N3O2S/c1-12-4-3-5-14(10-12)20-18-17(21-19-22(18)8-9-25-19)13-6-7-15(23)16(11-13)24-2/h3-11,20,23H,1-2H3
InChIKeyIZZVZRWZANPYSE-UHFFFAOYSA-N
XLogP4.83
TPSA58.79 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.43
LogP ≤ 54.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-methoxy-4-[5-(3-methylanilino)imidazo[2,1-b][1,3]thiazol-6-yl]phenol 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 2-methoxy-4-[5-(3-methylanilino)imidazo[2,1-b][1,3]thiazol-6-yl]phenol?
The IUPAC name of 2-methoxy-4-[5-(3-methylanilino)imidazo[2,1-b][1,3]thiazol-6-yl]phenol (CID 7066893) is 2-methoxy-4-[5-(3-methylanilino)imidazo[2,1-b][1,3]thiazol-6-yl]phenol.
What is the SMILES notation for 2-methoxy-4-[5-(3-methylanilino)imidazo[2,1-b][1,3]thiazol-6-yl]phenol?
The canonical SMILES for 2-methoxy-4-[5-(3-methylanilino)imidazo[2,1-b][1,3]thiazol-6-yl]phenol is COc1cc(-c2nc3sccn3c2Nc2cccc(C)c2)ccc1O.
What is the InChIKey of 2-methoxy-4-[5-(3-methylanilino)imidazo[2,1-b][1,3]thiazol-6-yl]phenol?
The InChIKey is IZZVZRWZANPYSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O2S/c1-12-4-3-5-14(10-12)20-18-17(21-19-22(18)8-9-25-19)13-6-7-15(23)16(11-13)24-2/h3-11,20,23H,1-2H3.
What are the key properties of 2-methoxy-4-[5-(3-methylanilino)imidazo[2,1-b][1,3]thiazol-6-yl]phenol?
2-methoxy-4-[5-(3-methylanilino)imidazo[2,1-b][1,3]thiazol-6-yl]phenol has a molecular weight of 351.43 g/mol, XLogP of 4.83, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4-[5-(3-methylanilino)imidazo[2,1-b][1,3]thiazol-6-yl]phenol is sourced from PubChem (CID 7066893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).