1-(1-benzoyl-2,3-dihydroindol-6-yl)-3-phenylurea

C22H19N3O2 — CID 46384404

IUPAC1-(1-benzoyl-2,3-dihydroindol-6-yl)-3-phenylurea
SMILESO=C(Nc1ccccc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CC2
InChIInChI=1S/C22H19N3O2/c26-21(17-7-3-1-4-8-17)25-14-13-16-11-12-19(15-20(16)25)24-22(27)23-18-9-5-2-6-10-18/h1-12,15H,13-14H2,(H2,23,24,27)
InChIKeyXGABYFWAQDSGQV-UHFFFAOYSA-N
MW357.41 g/mol
LogP4.53
Rot. Bonds3

About 1-(1-benzoyl-2,3-dihydroindol-6-yl)-3-phenylurea

1-(1-benzoyl-2,3-dihydroindol-6-yl)-3-phenylurea (PubChem CID 46384404) has the molecular formula C22H19N3O2 and a molecular weight of 357.41 g/mol. Its IUPAC name is 1-(1-benzoyl-2,3-dihydroindol-6-yl)-3-phenylurea.

Molecular Properties

Compound Name1-(1-benzoyl-2,3-dihydroindol-6-yl)-3-phenylurea
PubChem CID46384404
Molecular FormulaC22H19N3O2
Molecular Weight357.41 g/mol
Exact Mass357.15
IUPAC Name1-(1-benzoyl-2,3-dihydroindol-6-yl)-3-phenylurea
SMILESO=C(Nc1ccccc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CC2
InChIInChI=1S/C22H19N3O2/c26-21(17-7-3-1-4-8-17)25-14-13-16-11-12-19(15-20(16)25)24-22(27)23-18-9-5-2-6-10-18/h1-12,15H,13-14H2,(H2,23,24,27)
InChIKeyXGABYFWAQDSGQV-UHFFFAOYSA-N
XLogP4.53
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 54.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-(1-benzoyl-2,3-dihydroindol-6-yl)-3-phenylurea 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-(1-benzoyl-2,3-dihydroindol-6-yl)-3-[3-(trifluoromethyl)phenyl]urea
CID 46384446
1-(1-benzoyl-3,4-dihydro-2H-quinolin-7-yl)-3-(4-chlorophenyl)urea
CID 30372487
1-(1-benzoyl-2,3-dihydroindol-6-yl)-3-(2,5-difluorophenyl)urea
CID 46384443
1-(1-benzoyl-3,4-dihydro-2H-quinolin-7-yl)-3-(3-methoxyphenyl)urea
CID 30372497
1-(1-benzoyl-2,3-dihydroindol-6-yl)-3-(3-methoxypropyl)urea
CID 46384438
1-[1-(4-methylbenzoyl)-2,3-dihydroindol-6-yl]-3-(2-methylphenyl)urea
CID 46384359
1-(1-benzoyl-2,3-dihydroindol-6-yl)-3-(5-chloro-2,4-dimethoxyphenyl)urea
CID 46384423
1-[(1-benzoyl-2,3-dihydroindol-6-yl)methyl]-3-(3,4-dimethylphenyl)urea
CID 53043814
1-(3,4-dimethylphenyl)-3-[1-(4-methylbenzoyl)-2,3-dihydroindol-6-yl]urea
CID 46384350
1-(3-methoxyphenyl)-3-[1-(4-methylbenzoyl)-2,3-dihydroindol-6-yl]urea
CID 46384342
1-(1-benzoyl-3,4-dihydro-2H-quinolin-7-yl)-3-(2-methoxyphenyl)urea
CID 30372555
1-[(1-benzoyl-2,3-dihydroindol-6-yl)methyl]-3-(4-ethoxyphenyl)urea
CID 53099512

Frequently Asked Questions

What is the IUPAC name of 1-(1-benzoyl-2,3-dihydroindol-6-yl)-3-phenylurea?
The IUPAC name of 1-(1-benzoyl-2,3-dihydroindol-6-yl)-3-phenylurea (CID 46384404) is 1-(1-benzoyl-2,3-dihydroindol-6-yl)-3-phenylurea.
What is the SMILES notation for 1-(1-benzoyl-2,3-dihydroindol-6-yl)-3-phenylurea?
The canonical SMILES for 1-(1-benzoyl-2,3-dihydroindol-6-yl)-3-phenylurea is O=C(Nc1ccccc1)Nc1ccc2c(c1)N(C(=O)c1ccccc1)CC2.
What is the InChIKey of 1-(1-benzoyl-2,3-dihydroindol-6-yl)-3-phenylurea?
The InChIKey is XGABYFWAQDSGQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O2/c26-21(17-7-3-1-4-8-17)25-14-13-16-11-12-19(15-20(16)25)24-22(27)23-18-9-5-2-6-10-18/h1-12,15H,13-14H2,(H2,23,24,27).
What are the key properties of 1-(1-benzoyl-2,3-dihydroindol-6-yl)-3-phenylurea?
1-(1-benzoyl-2,3-dihydroindol-6-yl)-3-phenylurea has a molecular weight of 357.41 g/mol, XLogP of 4.53, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-benzoyl-2,3-dihydroindol-6-yl)-3-phenylurea is sourced from PubChem (CID 46384404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).