1-[5-[(4-methoxyphenyl)sulfamoyl]-2-morpholin-4-ylphenyl]-3-phenylurea

C24H26N4O5S — CID 4185237

IUPAC1-[5-[(4-methoxyphenyl)sulfamoyl]-2-morpholin-4-ylphenyl]-3-phenylurea
SMILESCOc1ccc(NS(=O)(=O)c2ccc(N3CCOCC3)c(NC(=O)Nc3ccccc3)c2)cc1
InChIInChI=1S/C24H26N4O5S/c1-32-20-9-7-19(8-10-20)27-34(30,31)21-11-12-23(28-13-15-33-16-14-28)22(17-21)26-24(29)25-18-5-3-2-4-6-18/h2-12,17,27H,13-16H2,1H3,(H2,25,26,29)
InChIKeyWKIFMAACRIDWKV-UHFFFAOYSA-N
MW482.56 g/mol
LogP3.98
Rot. Bonds7

About 1-[5-[(4-methoxyphenyl)sulfamoyl]-2-morpholin-4-ylphenyl]-3-phenylurea

1-[5-[(4-methoxyphenyl)sulfamoyl]-2-morpholin-4-ylphenyl]-3-phenylurea (PubChem CID 4185237) has the molecular formula C24H26N4O5S and a molecular weight of 482.56 g/mol. Its IUPAC name is 1-[5-[(4-methoxyphenyl)sulfamoyl]-2-morpholin-4-ylphenyl]-3-phenylurea.

Molecular Properties

Compound Name1-[5-[(4-methoxyphenyl)sulfamoyl]-2-morpholin-4-ylphenyl]-3-phenylurea
PubChem CID4185237
Molecular FormulaC24H26N4O5S
Molecular Weight482.56 g/mol
Exact Mass482.16
IUPAC Name1-[5-[(4-methoxyphenyl)sulfamoyl]-2-morpholin-4-ylphenyl]-3-phenylurea
SMILESCOc1ccc(NS(=O)(=O)c2ccc(N3CCOCC3)c(NC(=O)Nc3ccccc3)c2)cc1
InChIInChI=1S/C24H26N4O5S/c1-32-20-9-7-19(8-10-20)27-34(30,31)21-11-12-23(28-13-15-33-16-14-28)22(17-21)26-24(29)25-18-5-3-2-4-6-18/h2-12,17,27H,13-16H2,1H3,(H2,25,26,29)
InChIKeyWKIFMAACRIDWKV-UHFFFAOYSA-N
XLogP3.98
TPSA109.00 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500482.56
LogP ≤ 53.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

4-[5-[(4-methoxyphenyl)sulfamoyl]-2-morpholin-4-ylanilino]-4-oxobut-2-enoic acid
CID 4868398
1-(3-methoxyphenyl)-3-(2-morpholin-4-ylphenyl)urea
CID 108869153
N-[5-[(4-methoxyphenyl)sulfamoyl]-2-pyrrolidin-1-ylphenyl]pyridine-4-carboxamide
CID 4857237
N-[5-[(2-methoxyphenyl)sulfamoyl]-2-morpholin-4-ylphenyl]-4-(thiophen-2-ylsulfonylamino)benzamide
CID 5168482
1-(2,3-dimethylphenyl)-3-[5-[(4-methoxyphenyl)sulfamoyl]-2-pyrrolidin-1-ylphenyl]thiourea
CID 3516620
2-(2-fluorophenyl)-N-[3-[(4-methoxyphenyl)sulfamoyl]-4-morpholin-4-ylphenyl]acetamide
CID 3933606
1-(4-fluorophenyl)-N-[5-[(4-methoxyphenyl)sulfamoyl]-2-morpholin-4-ylphenyl]-3-methylthieno[3,2-d]pyrazole-5-carboxamide
CID 4123479
N-[5-[(4-chlorophenyl)sulfamoyl]-2-morpholin-4-ylphenyl]thiophene-2-carboxamide
CID 4626135
1-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]-3-(4-nitrophenyl)urea
CID 3500250
N-[[5-[(4-chlorophenyl)sulfamoyl]-2-morpholin-4-ylphenyl]carbamothioyl]-4-methylbenzamide
CID 4246175
N-(4-methoxyphenyl)-2-(2-morpholin-4-ylanilino)acetamide
CID 109009136
1-(4-methoxyphenyl)-3-[2-[(4-methylphenyl)sulfonylamino]phenyl]urea
CID 118386826

Frequently Asked Questions

What is the IUPAC name of 1-[5-[(4-methoxyphenyl)sulfamoyl]-2-morpholin-4-ylphenyl]-3-phenylurea?
The IUPAC name of 1-[5-[(4-methoxyphenyl)sulfamoyl]-2-morpholin-4-ylphenyl]-3-phenylurea (CID 4185237) is 1-[5-[(4-methoxyphenyl)sulfamoyl]-2-morpholin-4-ylphenyl]-3-phenylurea.
What is the SMILES notation for 1-[5-[(4-methoxyphenyl)sulfamoyl]-2-morpholin-4-ylphenyl]-3-phenylurea?
The canonical SMILES for 1-[5-[(4-methoxyphenyl)sulfamoyl]-2-morpholin-4-ylphenyl]-3-phenylurea is COc1ccc(NS(=O)(=O)c2ccc(N3CCOCC3)c(NC(=O)Nc3ccccc3)c2)cc1.
What is the InChIKey of 1-[5-[(4-methoxyphenyl)sulfamoyl]-2-morpholin-4-ylphenyl]-3-phenylurea?
The InChIKey is WKIFMAACRIDWKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N4O5S/c1-32-20-9-7-19(8-10-20)27-34(30,31)21-11-12-23(28-13-15-33-16-14-28)22(17-21)26-24(29)25-18-5-3-2-4-6-18/h2-12,17,27H,13-16H2,1H3,(H2,25,26,29).
What are the key properties of 1-[5-[(4-methoxyphenyl)sulfamoyl]-2-morpholin-4-ylphenyl]-3-phenylurea?
1-[5-[(4-methoxyphenyl)sulfamoyl]-2-morpholin-4-ylphenyl]-3-phenylurea has a molecular weight of 482.56 g/mol, XLogP of 3.98, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-[(4-methoxyphenyl)sulfamoyl]-2-morpholin-4-ylphenyl]-3-phenylurea is sourced from PubChem (CID 4185237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).