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

C20H18N6OS — CID 142621167

IUPAC(2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-[1-(1-methylpyrrolo[2,3-b]pyridin-5-yl)pyrazol-4-yl]methanol
SMILESCn1ccc2cc(-n3cc(C(O)c4c(C5CC5)sc5cncn45)cn3)cnc21
InChIInChI=1S/C20H18N6OS/c1-24-5-4-13-6-15(8-22-20(13)24)26-10-14(7-23-26)18(27)17-19(12-2-3-12)28-16-9-21-11-25(16)17/h4-12,18,27H,2-3H2,1H3
InChIKeySZKMUUBVKZJGLP-UHFFFAOYSA-N
MW390.47 g/mol
LogP3.43
Rot. Bonds4

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

(2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-[1-(1-methylpyrrolo[2,3-b]pyridin-5-yl)pyrazol-4-yl]methanol (PubChem CID 142621167) has the molecular formula C20H18N6OS and a molecular weight of 390.47 g/mol. Its IUPAC name is (2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-[1-(1-methylpyrrolo[2,3-b]pyridin-5-yl)pyrazol-4-yl]methanol.

Molecular Properties

Compound Name(2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-[1-(1-methylpyrrolo[2,3-b]pyridin-5-yl)pyrazol-4-yl]methanol
PubChem CID142621167
Molecular FormulaC20H18N6OS
Molecular Weight390.47 g/mol
Exact Mass390.13
IUPAC Name(2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-[1-(1-methylpyrrolo[2,3-b]pyridin-5-yl)pyrazol-4-yl]methanol
SMILESCn1ccc2cc(-n3cc(C(O)c4c(C5CC5)sc5cncn45)cn3)cnc21
InChIInChI=1S/C20H18N6OS/c1-24-5-4-13-6-15(8-22-20(13)24)26-10-14(7-23-26)18(27)17-19(12-2-3-12)28-16-9-21-11-25(16)17/h4-12,18,27H,2-3H2,1H3
InChIKeySZKMUUBVKZJGLP-UHFFFAOYSA-N
XLogP3.43
TPSA73.17 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.47
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze (2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-[1-(1-methylpyrrolo[2,3-b]pyridin-5-yl)pyrazol-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

Related Compounds

US11254668, Example 467
CID 137502646
US11267824, Example 125
CID 149751989
[1-(1,3-dimethyl-1H-pyrazolo[3,4-d][1,3]thiazol-5-yl)piperidin-4-yl](pyridin-2-yl)methanol
CID 72838851
(R)-(2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(1-phenyltriazol-4-yl)methanol
CID 142621196
(2-Cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-[1-[2-(trifluoromethyl)phenyl]triazol-4-yl]methanol
CID 142621228
(2-Cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-[1-[4-(trifluoromethyl)phenyl]triazol-4-yl]methanol
CID 142621279
(2-Cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-[1-[3-(trifluoromethyl)phenyl]triazol-4-yl]methanol
CID 142621459
(R)-(2-cyclopropyl-6H-imidazo[5,1-b][1,3]thiazol-4-ium-3-yl)-(1-phenyltriazol-4-yl)methanol
CID 172677841
[4-[2-[1-(3-Methylbutyl)pyrazol-4-yl]imidazo[1,2-a]pyridin-6-yl]-1,3-thiazol-2-yl]methanol
CID 66623798
[5-(7-Amino-[1,3]thiazolo[5,4-d]pyrimidin-2-yl)-1-methyl-4-phenylimidazol-2-yl]-(2,5-dimethylpyrazol-3-yl)methanol
CID 69194231
(4S)-4-[6-[6-(1,3-dimethylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-benzothiazol-2-yl]-4-hydroxybutanenitrile
CID 71017545
[6-[2-[(2-Ethyl-4,5,6,7-tetrahydroindazol-3-yl)amino]-5-methyl-1,3-thiazol-4-yl]-3-(4-methylimidazol-1-yl)-2-pyridinyl]methanol
CID 118684947

Frequently Asked Questions

What is the IUPAC name of (2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-[1-(1-methylpyrrolo[2,3-b]pyridin-5-yl)pyrazol-4-yl]methanol?
The IUPAC name of (2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-[1-(1-methylpyrrolo[2,3-b]pyridin-5-yl)pyrazol-4-yl]methanol (CID 142621167) is (2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-[1-(1-methylpyrrolo[2,3-b]pyridin-5-yl)pyrazol-4-yl]methanol.
What is the SMILES notation for (2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-[1-(1-methylpyrrolo[2,3-b]pyridin-5-yl)pyrazol-4-yl]methanol?
The canonical SMILES for (2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-[1-(1-methylpyrrolo[2,3-b]pyridin-5-yl)pyrazol-4-yl]methanol is Cn1ccc2cc(-n3cc(C(O)c4c(C5CC5)sc5cncn45)cn3)cnc21.
What is the InChIKey of (2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-[1-(1-methylpyrrolo[2,3-b]pyridin-5-yl)pyrazol-4-yl]methanol?
The InChIKey is SZKMUUBVKZJGLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N6OS/c1-24-5-4-13-6-15(8-22-20(13)24)26-10-14(7-23-26)18(27)17-19(12-2-3-12)28-16-9-21-11-25(16)17/h4-12,18,27H,2-3H2,1H3.
What are the key properties of (2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-[1-(1-methylpyrrolo[2,3-b]pyridin-5-yl)pyrazol-4-yl]methanol?
(2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-[1-(1-methylpyrrolo[2,3-b]pyridin-5-yl)pyrazol-4-yl]methanol has a molecular weight of 390.47 g/mol, XLogP of 3.43, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-[1-(1-methylpyrrolo[2,3-b]pyridin-5-yl)pyrazol-4-yl]methanol is sourced from PubChem (CID 142621167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).