1-[4-(ethylsulfamoyl)phenyl]-3-(2-morpholin-4-ylethyl)thiourea

C15H24N4O3S2 — CID 17255659

IUPAC1-[4-(ethylsulfamoyl)phenyl]-3-(2-morpholin-4-ylethyl)thiourea
SMILESCCNS(=O)(=O)c1ccc(NC(=S)NCCN2CCOCC2)cc1
InChIInChI=1S/C15H24N4O3S2/c1-2-17-24(20,21)14-5-3-13(4-6-14)18-15(23)16-7-8-19-9-11-22-12-10-19/h3-6,17H,2,7-12H2,1H3,(H2,16,18,23)
InChIKeyIWJLRQFXMLLMPP-UHFFFAOYSA-N
MW372.52 g/mol
LogP0.60
Rot. Bonds7

About 1-[4-(ethylsulfamoyl)phenyl]-3-(2-morpholin-4-ylethyl)thiourea

1-[4-(ethylsulfamoyl)phenyl]-3-(2-morpholin-4-ylethyl)thiourea (PubChem CID 17255659) has the molecular formula C15H24N4O3S2 and a molecular weight of 372.52 g/mol. Its IUPAC name is 1-[4-(ethylsulfamoyl)phenyl]-3-(2-morpholin-4-ylethyl)thiourea.

Molecular Properties

Compound Name1-[4-(ethylsulfamoyl)phenyl]-3-(2-morpholin-4-ylethyl)thiourea
PubChem CID17255659
Molecular FormulaC15H24N4O3S2
Molecular Weight372.52 g/mol
Exact Mass372.13
IUPAC Name1-[4-(ethylsulfamoyl)phenyl]-3-(2-morpholin-4-ylethyl)thiourea
SMILESCCNS(=O)(=O)c1ccc(NC(=S)NCCN2CCOCC2)cc1
InChIInChI=1S/C15H24N4O3S2/c1-2-17-24(20,21)14-5-3-13(4-6-14)18-15(23)16-7-8-19-9-11-22-12-10-19/h3-6,17H,2,7-12H2,1H3,(H2,16,18,23)
InChIKeyIWJLRQFXMLLMPP-UHFFFAOYSA-N
XLogP0.60
TPSA82.70 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.52
LogP ≤ 50.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

Analyze 1-[4-(ethylsulfamoyl)phenyl]-3-(2-morpholin-4-ylethyl)thiourea 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

1-(4-butylphenyl)-3-(2-morpholin-4-ylethyl)thiourea
CID 2192072
1-(3-morpholin-4-ylpropyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)thiourea
CID 8624491
1-[4-(ethylsulfamoyl)phenyl]-3-(2-methoxyethyl)thiourea
CID 19680553
N,N-diethyl-4-(3-morpholin-4-ylpropylcarbamothioylamino)benzamide
CID 4968567
(2S)-2-[(4-acetamidophenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)propanamide
CID 24619756
1-(4-methylsulfanylphenyl)-3-(3-morpholin-4-ylpropyl)thiourea
CID 8564807
1-(4-ethoxyphenyl)-3-(2-morpholin-4-ylethylcarbamothioylamino)thiourea
CID 8618749
1-[4-(ethylsulfamoyl)phenyl]-3-phenylthiourea
CID 19680507
1-(3,4-dipropoxyphenyl)-3-(2-morpholin-4-ylethyl)thiourea
CID 8660334
1-[4-(1-adamantyl)phenyl]-3-(2-morpholin-4-ylethyl)thiourea
CID 8659923
1-cyclopropyl-3-[4-(ethylsulfamoyl)phenyl]thiourea
CID 19680552
4-(1-hydroxyethyl)-N-(2-morpholin-4-ylethyl)benzenesulfonamide
CID 43507444

Frequently Asked Questions

What is the IUPAC name of 1-[4-(ethylsulfamoyl)phenyl]-3-(2-morpholin-4-ylethyl)thiourea?
The IUPAC name of 1-[4-(ethylsulfamoyl)phenyl]-3-(2-morpholin-4-ylethyl)thiourea (CID 17255659) is 1-[4-(ethylsulfamoyl)phenyl]-3-(2-morpholin-4-ylethyl)thiourea.
What is the SMILES notation for 1-[4-(ethylsulfamoyl)phenyl]-3-(2-morpholin-4-ylethyl)thiourea?
The canonical SMILES for 1-[4-(ethylsulfamoyl)phenyl]-3-(2-morpholin-4-ylethyl)thiourea is CCNS(=O)(=O)c1ccc(NC(=S)NCCN2CCOCC2)cc1.
What is the InChIKey of 1-[4-(ethylsulfamoyl)phenyl]-3-(2-morpholin-4-ylethyl)thiourea?
The InChIKey is IWJLRQFXMLLMPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O3S2/c1-2-17-24(20,21)14-5-3-13(4-6-14)18-15(23)16-7-8-19-9-11-22-12-10-19/h3-6,17H,2,7-12H2,1H3,(H2,16,18,23).
What are the key properties of 1-[4-(ethylsulfamoyl)phenyl]-3-(2-morpholin-4-ylethyl)thiourea?
1-[4-(ethylsulfamoyl)phenyl]-3-(2-morpholin-4-ylethyl)thiourea has a molecular weight of 372.52 g/mol, XLogP of 0.60, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(ethylsulfamoyl)phenyl]-3-(2-morpholin-4-ylethyl)thiourea is sourced from PubChem (CID 17255659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).