N'-[2-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]acetyl]-2-(4-methyl-1,3-thiazol-2-yl)acetohydrazide

C16H20N4O2S2 — CID 41292732

About N'-[2-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]acetyl]-2-(4-methyl-1,3-thiazol-2-yl)acetohydrazide

N'-[2-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]acetyl]-2-(4-methyl-1,3-thiazol-2-yl)acetohydrazide (PubChem CID 41292732) has the molecular formula C16H20N4O2S2 and a molecular weight of 364.50 g/mol. Its IUPAC name is N'-[2-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]acetyl]-2-(4-methyl-1,3-thiazol-2-yl)acetohydrazide.

Molecular Properties

• Compound Name: N'-[2-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]acetyl]-2-(4-methyl-1,3-thiazol-2-yl)acetohydrazide
• PubChem CID: 41292732
• Molecular Formula: C16H20N4O2S2
• Molecular Weight: 364.50 g/mol
• Exact Mass: 364.10
• IUPAC Name: N'-[2-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]acetyl]-2-(4-methyl-1,3-thiazol-2-yl)acetohydrazide
• SMILES: Cc1csc(CC(=O)NNC(=O)CN2CCc3sccc3[C@@H]2C)n1
• InChI: InChI=1S/C16H20N4O2S2/c1-10-9-24-16(17-10)7-14(21)18-19-15(22)8-20-5-3-13-12(11(20)2)4-6-23-13/h4,6,9,11H,3,5,7-8H2,1-2H3,(H,18,21)(H,19,22)/t11-/m0/s1
• InChIKey: AHVDOFBDGAEUKL-NSHDSACASA-N
• XLogP: 1.82
• TPSA: 74.33 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 4
• Heavy Atoms: 24
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	364.50
LogP ≤ 5	1.82
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N'-[2-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]acetyl]-2-(4-methyl-1,3-thiazol-2-yl)acetohydrazide?

The IUPAC name of N'-[2-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]acetyl]-2-(4-methyl-1,3-thiazol-2-yl)acetohydrazide (CID 41292732) is N'-[2-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]acetyl]-2-(4-methyl-1,3-thiazol-2-yl)acetohydrazide.

What is the SMILES notation for N'-[2-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]acetyl]-2-(4-methyl-1,3-thiazol-2-yl)acetohydrazide?

The canonical SMILES for N'-[2-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]acetyl]-2-(4-methyl-1,3-thiazol-2-yl)acetohydrazide is Cc1csc(CC(=O)NNC(=O)CN2CCc3sccc3[C@@H]2C)n1.

What is the InChIKey of N'-[2-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]acetyl]-2-(4-methyl-1,3-thiazol-2-yl)acetohydrazide?

The InChIKey is AHVDOFBDGAEUKL-NSHDSACASA-N. The full InChI is InChI=1S/C16H20N4O2S2/c1-10-9-24-16(17-10)7-14(21)18-19-15(22)8-20-5-3-13-12(11(20)2)4-6-23-13/h4,6,9,11H,3,5,7-8H2,1-2H3,(H,18,21)(H,19,22)/t11-/m0/s1.

What are the key properties of N'-[2-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]acetyl]-2-(4-methyl-1,3-thiazol-2-yl)acetohydrazide?

N'-[2-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]acetyl]-2-(4-methyl-1,3-thiazol-2-yl)acetohydrazide has a molecular weight of 364.50 g/mol, XLogP of 1.82, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N'-[2-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]acetyl]-2-(4-methyl-1,3-thiazol-2-yl)acetohydrazide is sourced from PubChem (CID 41292732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).