1-(2-methoxyphenyl)-3-(1-propylsulfonyl-2,3-dihydroindol-6-yl)urea

C19H23N3O4S — CID 46386154

IUPAC1-(2-methoxyphenyl)-3-(1-propylsulfonyl-2,3-dihydroindol-6-yl)urea
SMILESCCCS(=O)(=O)N1CCc2ccc(NC(=O)Nc3ccccc3OC)cc21
InChIInChI=1S/C19H23N3O4S/c1-3-12-27(24,25)22-11-10-14-8-9-15(13-17(14)22)20-19(23)21-16-6-4-5-7-18(16)26-2/h4-9,13H,3,10-12H2,1-2H3,(H2,20,21,23)
InChIKeyLOVGZUCTWCMYOF-UHFFFAOYSA-N
MW389.48 g/mol
LogP3.44
Rot. Bonds6

About 1-(2-methoxyphenyl)-3-(1-propylsulfonyl-2,3-dihydroindol-6-yl)urea

1-(2-methoxyphenyl)-3-(1-propylsulfonyl-2,3-dihydroindol-6-yl)urea (PubChem CID 46386154) has the molecular formula C19H23N3O4S and a molecular weight of 389.48 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-3-(1-propylsulfonyl-2,3-dihydroindol-6-yl)urea.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-3-(1-propylsulfonyl-2,3-dihydroindol-6-yl)urea
PubChem CID46386154
Molecular FormulaC19H23N3O4S
Molecular Weight389.48 g/mol
Exact Mass389.14
IUPAC Name1-(2-methoxyphenyl)-3-(1-propylsulfonyl-2,3-dihydroindol-6-yl)urea
SMILESCCCS(=O)(=O)N1CCc2ccc(NC(=O)Nc3ccccc3OC)cc21
InChIInChI=1S/C19H23N3O4S/c1-3-12-27(24,25)22-11-10-14-8-9-15(13-17(14)22)20-19(23)21-16-6-4-5-7-18(16)26-2/h4-9,13H,3,10-12H2,1-2H3,(H2,20,21,23)
InChIKeyLOVGZUCTWCMYOF-UHFFFAOYSA-N
XLogP3.44
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.48
LogP ≤ 53.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-methoxyphenoxy)-N-(1-propylsulfonyl-3,4-dihydro-2H-quinolin-7-yl)acetamide
CID 27636830
1-(2-methylphenyl)-3-(1-methylsulfonyl-2,3-dihydroindol-6-yl)urea
CID 46386198
1-(1-benzoyl-3,4-dihydro-2H-quinolin-7-yl)-3-(2-methoxyphenyl)urea
CID 30372555
2,2-dimethyl-N-(1-propylsulfonyl-3,4-dihydro-2H-quinolin-7-yl)propanamide
CID 27636751
1-(1-ethylsulfonyl-2,3-dihydroindol-6-yl)-3-(3-methylsulfanylphenyl)urea
CID 46386100
N-(1-propylsulfonyl-3,4-dihydro-2H-quinolin-7-yl)butanamide
CID 27620897
1-(5-chloro-2-methoxyphenyl)-3-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-7-yl)urea
CID 30372695
1-butan-2-yl-3-(1-ethylsulfonyl-2,3-dihydroindol-6-yl)urea
CID 46386113
1-propylsulfonyl-2,3-dihydroindole-6-carboxylic acid
CID 113382378
1-(2-methoxyphenyl)-3-[1-(4-methoxyphenyl)sulfonyl-3,4-dihydro-2H-quinolin-6-yl]urea
CID 30374549
N-(1-butylsulfonyl-2,3-dihydroindol-6-yl)-2-(4-fluorophenyl)acetamide
CID 112506348
2-(4-fluorophenyl)-N-(1-propylsulfonyl-3,4-dihydro-2H-quinolin-7-yl)acetamide
CID 27636833

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-3-(1-propylsulfonyl-2,3-dihydroindol-6-yl)urea?
The IUPAC name of 1-(2-methoxyphenyl)-3-(1-propylsulfonyl-2,3-dihydroindol-6-yl)urea (CID 46386154) is 1-(2-methoxyphenyl)-3-(1-propylsulfonyl-2,3-dihydroindol-6-yl)urea.
What is the SMILES notation for 1-(2-methoxyphenyl)-3-(1-propylsulfonyl-2,3-dihydroindol-6-yl)urea?
The canonical SMILES for 1-(2-methoxyphenyl)-3-(1-propylsulfonyl-2,3-dihydroindol-6-yl)urea is CCCS(=O)(=O)N1CCc2ccc(NC(=O)Nc3ccccc3OC)cc21.
What is the InChIKey of 1-(2-methoxyphenyl)-3-(1-propylsulfonyl-2,3-dihydroindol-6-yl)urea?
The InChIKey is LOVGZUCTWCMYOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O4S/c1-3-12-27(24,25)22-11-10-14-8-9-15(13-17(14)22)20-19(23)21-16-6-4-5-7-18(16)26-2/h4-9,13H,3,10-12H2,1-2H3,(H2,20,21,23).
What are the key properties of 1-(2-methoxyphenyl)-3-(1-propylsulfonyl-2,3-dihydroindol-6-yl)urea?
1-(2-methoxyphenyl)-3-(1-propylsulfonyl-2,3-dihydroindol-6-yl)urea has a molecular weight of 389.48 g/mol, XLogP of 3.44, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-3-(1-propylsulfonyl-2,3-dihydroindol-6-yl)urea is sourced from PubChem (CID 46386154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).