2-(2,6-dichloro-4-cyclopropylphenyl)-N-(6-methylpyrimidin-4-yl)-[1,3]thiazolo[5,4-c]pyridin-4-amine

C20H15Cl2N5S — CID 66801628

IUPAC2-(2,6-dichloro-4-cyclopropylphenyl)-N-(6-methylpyrimidin-4-yl)-[1,3]thiazolo[5,4-c]pyridin-4-amine
SMILESCc1cc(Nc2nccc3nc(-c4c(Cl)cc(C5CC5)cc4Cl)sc23)ncn1
InChIInChI=1S/C20H15Cl2N5S/c1-10-6-16(25-9-24-10)27-19-18-15(4-5-23-19)26-20(28-18)17-13(21)7-12(8-14(17)22)11-2-3-11/h4-9,11H,2-3H2,1H3,(H,23,24,25,27)
InChIKeyMQWXSIOIGMFDHI-UHFFFAOYSA-N
MW428.35 g/mol
LogP6.38
Rot. Bonds4

About 2-(2,6-dichloro-4-cyclopropylphenyl)-N-(6-methylpyrimidin-4-yl)-[1,3]thiazolo[5,4-c]pyridin-4-amine

2-(2,6-dichloro-4-cyclopropylphenyl)-N-(6-methylpyrimidin-4-yl)-[1,3]thiazolo[5,4-c]pyridin-4-amine (PubChem CID 66801628) has the molecular formula C20H15Cl2N5S and a molecular weight of 428.35 g/mol. Its IUPAC name is 2-(2,6-dichloro-4-cyclopropylphenyl)-N-(6-methylpyrimidin-4-yl)-[1,3]thiazolo[5,4-c]pyridin-4-amine.

Molecular Properties

Compound Name2-(2,6-dichloro-4-cyclopropylphenyl)-N-(6-methylpyrimidin-4-yl)-[1,3]thiazolo[5,4-c]pyridin-4-amine
PubChem CID66801628
Molecular FormulaC20H15Cl2N5S
Molecular Weight428.35 g/mol
Exact Mass427.04
IUPAC Name2-(2,6-dichloro-4-cyclopropylphenyl)-N-(6-methylpyrimidin-4-yl)-[1,3]thiazolo[5,4-c]pyridin-4-amine
SMILESCc1cc(Nc2nccc3nc(-c4c(Cl)cc(C5CC5)cc4Cl)sc23)ncn1
InChIInChI=1S/C20H15Cl2N5S/c1-10-6-16(25-9-24-10)27-19-18-15(4-5-23-19)26-20(28-18)17-13(21)7-12(8-14(17)22)11-2-3-11/h4-9,11H,2-3H2,1H3,(H,23,24,25,27)
InChIKeyMQWXSIOIGMFDHI-UHFFFAOYSA-N
XLogP6.38
TPSA63.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500428.35
LogP ≤ 56.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-(2,6-dichloro-4-cyclopropylphenyl)-N-(6-methylpyrimidin-4-yl)-[1,3]thiazolo[5,4-c]pyridin-4-amine 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-(2,6-dichloro-4-cyclopropylphenyl)-N-(6-methylpyrimidin-4-yl)-[1,3]thiazolo[5,4-c]pyridin-4-amine?
The IUPAC name of 2-(2,6-dichloro-4-cyclopropylphenyl)-N-(6-methylpyrimidin-4-yl)-[1,3]thiazolo[5,4-c]pyridin-4-amine (CID 66801628) is 2-(2,6-dichloro-4-cyclopropylphenyl)-N-(6-methylpyrimidin-4-yl)-[1,3]thiazolo[5,4-c]pyridin-4-amine.
What is the SMILES notation for 2-(2,6-dichloro-4-cyclopropylphenyl)-N-(6-methylpyrimidin-4-yl)-[1,3]thiazolo[5,4-c]pyridin-4-amine?
The canonical SMILES for 2-(2,6-dichloro-4-cyclopropylphenyl)-N-(6-methylpyrimidin-4-yl)-[1,3]thiazolo[5,4-c]pyridin-4-amine is Cc1cc(Nc2nccc3nc(-c4c(Cl)cc(C5CC5)cc4Cl)sc23)ncn1.
What is the InChIKey of 2-(2,6-dichloro-4-cyclopropylphenyl)-N-(6-methylpyrimidin-4-yl)-[1,3]thiazolo[5,4-c]pyridin-4-amine?
The InChIKey is MQWXSIOIGMFDHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15Cl2N5S/c1-10-6-16(25-9-24-10)27-19-18-15(4-5-23-19)26-20(28-18)17-13(21)7-12(8-14(17)22)11-2-3-11/h4-9,11H,2-3H2,1H3,(H,23,24,25,27).
What are the key properties of 2-(2,6-dichloro-4-cyclopropylphenyl)-N-(6-methylpyrimidin-4-yl)-[1,3]thiazolo[5,4-c]pyridin-4-amine?
2-(2,6-dichloro-4-cyclopropylphenyl)-N-(6-methylpyrimidin-4-yl)-[1,3]thiazolo[5,4-c]pyridin-4-amine has a molecular weight of 428.35 g/mol, XLogP of 6.38, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dichloro-4-cyclopropylphenyl)-N-(6-methylpyrimidin-4-yl)-[1,3]thiazolo[5,4-c]pyridin-4-amine is sourced from PubChem (CID 66801628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).