(2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(1-phenylimidazol-4-yl)methanol

C18H16N4OS — CID 142621131

IUPAC(2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(1-phenylimidazol-4-yl)methanol
SMILESOC(c1cn(-c2ccccc2)cn1)c1c(C2CC2)sc2cncn12
InChIInChI=1S/C18H16N4OS/c23-17(14-9-21(11-20-14)13-4-2-1-3-5-13)16-18(12-6-7-12)24-15-8-19-10-22(15)16/h1-5,8-12,17,23H,6-7H2
InChIKeyINXDATXWDCYETO-UHFFFAOYSA-N
MW336.42 g/mol
LogP3.54
Rot. Bonds4

About (2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(1-phenylimidazol-4-yl)methanol

(2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(1-phenylimidazol-4-yl)methanol (PubChem CID 142621131) has the molecular formula C18H16N4OS and a molecular weight of 336.42 g/mol. Its IUPAC name is (2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(1-phenylimidazol-4-yl)methanol.

Molecular Properties

Compound Name(2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(1-phenylimidazol-4-yl)methanol
PubChem CID142621131
Molecular FormulaC18H16N4OS
Molecular Weight336.42 g/mol
Exact Mass336.10
IUPAC Name(2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(1-phenylimidazol-4-yl)methanol
SMILESOC(c1cn(-c2ccccc2)cn1)c1c(C2CC2)sc2cncn12
InChIInChI=1S/C18H16N4OS/c23-17(14-9-21(11-20-14)13-4-2-1-3-5-13)16-18(12-6-7-12)24-15-8-19-10-22(15)16/h1-5,8-12,17,23H,6-7H2
InChIKeyINXDATXWDCYETO-UHFFFAOYSA-N
XLogP3.54
TPSA55.35 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.42
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(1-phenylimidazol-4-yl)methanol 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-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(1-phenylimidazol-4-yl)methanol?
The IUPAC name of (2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(1-phenylimidazol-4-yl)methanol (CID 142621131) is (2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(1-phenylimidazol-4-yl)methanol.
What is the SMILES notation for (2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(1-phenylimidazol-4-yl)methanol?
The canonical SMILES for (2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(1-phenylimidazol-4-yl)methanol is OC(c1cn(-c2ccccc2)cn1)c1c(C2CC2)sc2cncn12.
What is the InChIKey of (2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(1-phenylimidazol-4-yl)methanol?
The InChIKey is INXDATXWDCYETO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4OS/c23-17(14-9-21(11-20-14)13-4-2-1-3-5-13)16-18(12-6-7-12)24-15-8-19-10-22(15)16/h1-5,8-12,17,23H,6-7H2.
What are the key properties of (2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(1-phenylimidazol-4-yl)methanol?
(2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(1-phenylimidazol-4-yl)methanol has a molecular weight of 336.42 g/mol, XLogP of 3.54, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(1-phenylimidazol-4-yl)methanol is sourced from PubChem (CID 142621131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).