N-[5-(5-chloro-2-hydroxyphenyl)-1H-pyrazol-4-yl]-6-methyl-5,6-dihydro-[1,3]thiazolo[5,4-c]pyridine-7-carboxamide

C17H14ClN5O2S — CID 142427601

About N-[5-(5-chloro-2-hydroxyphenyl)-1H-pyrazol-4-yl]-6-methyl-5,6-dihydro-[1,3]thiazolo[5,4-c]pyridine-7-carboxamide

N-[5-(5-chloro-2-hydroxyphenyl)-1H-pyrazol-4-yl]-6-methyl-5,6-dihydro-[1,3]thiazolo[5,4-c]pyridine-7-carboxamide (PubChem CID 142427601) has the molecular formula C17H14ClN5O2S and a molecular weight of 387.85 g/mol. Its IUPAC name is N-[5-(5-chloro-2-hydroxyphenyl)-1H-pyrazol-4-yl]-6-methyl-5,6-dihydro-[1,3]thiazolo[5,4-c]pyridine-7-carboxamide.

Molecular Properties

• Compound Name: N-[5-(5-chloro-2-hydroxyphenyl)-1H-pyrazol-4-yl]-6-methyl-5,6-dihydro-[1,3]thiazolo[5,4-c]pyridine-7-carboxamide
• PubChem CID: 142427601
• Molecular Formula: C17H14ClN5O2S
• Molecular Weight: 387.85 g/mol
• Exact Mass: 387.06
• IUPAC Name: N-[5-(5-chloro-2-hydroxyphenyl)-1H-pyrazol-4-yl]-6-methyl-5,6-dihydro-[1,3]thiazolo[5,4-c]pyridine-7-carboxamide
• SMILES: CC1NC=c2scnc2=C1C(=O)Nc1cn[nH]c1-c1cc(Cl)ccc1O
• InChI: InChI=1S/C17H14ClN5O2S/c1-8-14(16-13(6-19-8)26-7-20-16)17(25)22-11-5-21-23-15(11)10-4-9(18)2-3-12(10)24/h2-8,19,24H,1H3,(H,21,23)(H,22,25)
• InChIKey: QRIVNTUCZQBNHF-UHFFFAOYSA-N
• XLogP: 1.41
• TPSA: 102.93 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 6
• Rotatable Bonds: 3
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	387.85
LogP ≤ 5	1.41
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of N-[5-(5-chloro-2-hydroxyphenyl)-1H-pyrazol-4-yl]-6-methyl-5,6-dihydro-[1,3]thiazolo[5,4-c]pyridine-7-carboxamide?

The IUPAC name of N-[5-(5-chloro-2-hydroxyphenyl)-1H-pyrazol-4-yl]-6-methyl-5,6-dihydro-[1,3]thiazolo[5,4-c]pyridine-7-carboxamide (CID 142427601) is N-[5-(5-chloro-2-hydroxyphenyl)-1H-pyrazol-4-yl]-6-methyl-5,6-dihydro-[1,3]thiazolo[5,4-c]pyridine-7-carboxamide.

What is the SMILES notation for N-[5-(5-chloro-2-hydroxyphenyl)-1H-pyrazol-4-yl]-6-methyl-5,6-dihydro-[1,3]thiazolo[5,4-c]pyridine-7-carboxamide?

The canonical SMILES for N-[5-(5-chloro-2-hydroxyphenyl)-1H-pyrazol-4-yl]-6-methyl-5,6-dihydro-[1,3]thiazolo[5,4-c]pyridine-7-carboxamide is CC1NC=c2scnc2=C1C(=O)Nc1cn[nH]c1-c1cc(Cl)ccc1O.

What is the InChIKey of N-[5-(5-chloro-2-hydroxyphenyl)-1H-pyrazol-4-yl]-6-methyl-5,6-dihydro-[1,3]thiazolo[5,4-c]pyridine-7-carboxamide?

The InChIKey is QRIVNTUCZQBNHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14ClN5O2S/c1-8-14(16-13(6-19-8)26-7-20-16)17(25)22-11-5-21-23-15(11)10-4-9(18)2-3-12(10)24/h2-8,19,24H,1H3,(H,21,23)(H,22,25).

What are the key properties of N-[5-(5-chloro-2-hydroxyphenyl)-1H-pyrazol-4-yl]-6-methyl-5,6-dihydro-[1,3]thiazolo[5,4-c]pyridine-7-carboxamide?

N-[5-(5-chloro-2-hydroxyphenyl)-1H-pyrazol-4-yl]-6-methyl-5,6-dihydro-[1,3]thiazolo[5,4-c]pyridine-7-carboxamide has a molecular weight of 387.85 g/mol, XLogP of 1.41, 3 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-[5-(5-chloro-2-hydroxyphenyl)-1H-pyrazol-4-yl]-6-methyl-5,6-dihydro-[1,3]thiazolo[5,4-c]pyridine-7-carboxamide is sourced from PubChem (CID 142427601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).