N'-[5-(4-fluorophenyl)furan-2-carbonyl]-4-methyl-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide

C20H19FN4O4S — CID 26919839

IUPACN'-[5-(4-fluorophenyl)furan-2-carbonyl]-4-methyl-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide
SMILESCc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(-c2ccc(F)cc2)o1
InChIInChI=1S/C20H19FN4O4S/c1-12-17(30-20(22-12)25-8-10-28-11-9-25)19(27)24-23-18(26)16-7-6-15(29-16)13-2-4-14(21)5-3-13/h2-7H,8-11H2,1H3,(H,23,26)(H,24,27)
InChIKeyXROLDAGRQSALRF-UHFFFAOYSA-N
MW430.46 g/mol
LogP2.76
Rot. Bonds4

About N'-[5-(4-fluorophenyl)furan-2-carbonyl]-4-methyl-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide

N'-[5-(4-fluorophenyl)furan-2-carbonyl]-4-methyl-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide (PubChem CID 26919839) has the molecular formula C20H19FN4O4S and a molecular weight of 430.46 g/mol. Its IUPAC name is N'-[5-(4-fluorophenyl)furan-2-carbonyl]-4-methyl-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide.

Molecular Properties

Compound NameN'-[5-(4-fluorophenyl)furan-2-carbonyl]-4-methyl-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide
PubChem CID26919839
Molecular FormulaC20H19FN4O4S
Molecular Weight430.46 g/mol
Exact Mass430.11
IUPAC NameN'-[5-(4-fluorophenyl)furan-2-carbonyl]-4-methyl-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide
SMILESCc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(-c2ccc(F)cc2)o1
InChIInChI=1S/C20H19FN4O4S/c1-12-17(30-20(22-12)25-8-10-28-11-9-25)19(27)24-23-18(26)16-7-6-15(29-16)13-2-4-14(21)5-3-13/h2-7H,8-11H2,1H3,(H,23,26)(H,24,27)
InChIKeyXROLDAGRQSALRF-UHFFFAOYSA-N
XLogP2.76
TPSA96.70 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.46
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze N'-[5-(4-fluorophenyl)furan-2-carbonyl]-4-methyl-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide 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 N'-[5-(4-fluorophenyl)furan-2-carbonyl]-4-methyl-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide?
The IUPAC name of N'-[5-(4-fluorophenyl)furan-2-carbonyl]-4-methyl-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide (CID 26919839) is N'-[5-(4-fluorophenyl)furan-2-carbonyl]-4-methyl-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide.
What is the SMILES notation for N'-[5-(4-fluorophenyl)furan-2-carbonyl]-4-methyl-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide?
The canonical SMILES for N'-[5-(4-fluorophenyl)furan-2-carbonyl]-4-methyl-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide is Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(-c2ccc(F)cc2)o1.
What is the InChIKey of N'-[5-(4-fluorophenyl)furan-2-carbonyl]-4-methyl-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide?
The InChIKey is XROLDAGRQSALRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19FN4O4S/c1-12-17(30-20(22-12)25-8-10-28-11-9-25)19(27)24-23-18(26)16-7-6-15(29-16)13-2-4-14(21)5-3-13/h2-7H,8-11H2,1H3,(H,23,26)(H,24,27).
What are the key properties of N'-[5-(4-fluorophenyl)furan-2-carbonyl]-4-methyl-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide?
N'-[5-(4-fluorophenyl)furan-2-carbonyl]-4-methyl-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide has a molecular weight of 430.46 g/mol, XLogP of 2.76, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[5-(4-fluorophenyl)furan-2-carbonyl]-4-methyl-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide is sourced from PubChem (CID 26919839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).