8-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-4H-chromeno[3,4-d][1,2]oxazole

C19H16N2O4S — CID 46394778

IUPAC8-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-4H-chromeno[3,4-d][1,2]oxazole
SMILESCC1Cc2ccccc2N1S(=O)(=O)c1ccc2c(c1)-c1oncc1CO2
InChIInChI=1S/C19H16N2O4S/c1-12-8-13-4-2-3-5-17(13)21(12)26(22,23)15-6-7-18-16(9-15)19-14(11-24-18)10-20-25-19/h2-7,9-10,12H,8,11H2,1H3
InChIKeyMFPRPVXMXZWYJF-UHFFFAOYSA-N
MW368.41 g/mol
LogP3.37
Rot. Bonds2

About 8-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-4H-chromeno[3,4-d][1,2]oxazole

8-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-4H-chromeno[3,4-d][1,2]oxazole (PubChem CID 46394778) has the molecular formula C19H16N2O4S and a molecular weight of 368.41 g/mol. Its IUPAC name is 8-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-4H-chromeno[3,4-d][1,2]oxazole.

Molecular Properties

Compound Name8-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-4H-chromeno[3,4-d][1,2]oxazole
PubChem CID46394778
Molecular FormulaC19H16N2O4S
Molecular Weight368.41 g/mol
Exact Mass368.08
IUPAC Name8-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-4H-chromeno[3,4-d][1,2]oxazole
SMILESCC1Cc2ccccc2N1S(=O)(=O)c1ccc2c(c1)-c1oncc1CO2
InChIInChI=1S/C19H16N2O4S/c1-12-8-13-4-2-3-5-17(13)21(12)26(22,23)15-6-7-18-16(9-15)19-14(11-24-18)10-20-25-19/h2-7,9-10,12H,8,11H2,1H3
InChIKeyMFPRPVXMXZWYJF-UHFFFAOYSA-N
XLogP3.37
TPSA72.64 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.41
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 8-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-4H-chromeno[3,4-d][1,2]oxazole 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

(2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-methyl-2,3-dihydroindole
CID 2552012
6-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-1,3-benzoxazole
CID 110759759
(2R)-1-(4-bromo-3-methylphenyl)sulfonyl-2-methyl-2,3-dihydroindole
CID 7510411
2-fluoro-4-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]aniline
CID 82845026
1-(6-methoxynaphthalen-2-yl)sulfonyl-2-methyl-2,3-dihydroindole
CID 56727561
(2R)-1-[(5-bromo-6-chloro-3-pyridinyl)sulfonyl]-2-methyl-2,3-dihydroindole
CID 1034220
N-[2-chloro-4-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]phenyl]acetamide
CID 23853086
4-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]benzonitrile
CID 24694007
2-methyl-1-(4-phenoxyphenyl)sulfonyl-2,3-dihydroindole
CID 43915536
N'-[3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]benzoyl]-2,3-dihydro-1,4-benzodioxine-6-carbohydrazide
CID 55455151
2-methyl-1-(1-phenylpyrazol-4-yl)sulfonyl-2,3-dihydroindole
CID 51126282
6-methyl-7-[[(2S)-2-methyl-2,3-dihydroindol-1-yl]sulfonyl]-4H-1,4-benzoxazin-3-one
CID 92683798

Frequently Asked Questions

What is the IUPAC name of 8-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-4H-chromeno[3,4-d][1,2]oxazole?
The IUPAC name of 8-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-4H-chromeno[3,4-d][1,2]oxazole (CID 46394778) is 8-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-4H-chromeno[3,4-d][1,2]oxazole.
What is the SMILES notation for 8-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-4H-chromeno[3,4-d][1,2]oxazole?
The canonical SMILES for 8-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-4H-chromeno[3,4-d][1,2]oxazole is CC1Cc2ccccc2N1S(=O)(=O)c1ccc2c(c1)-c1oncc1CO2.
What is the InChIKey of 8-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-4H-chromeno[3,4-d][1,2]oxazole?
The InChIKey is MFPRPVXMXZWYJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O4S/c1-12-8-13-4-2-3-5-17(13)21(12)26(22,23)15-6-7-18-16(9-15)19-14(11-24-18)10-20-25-19/h2-7,9-10,12H,8,11H2,1H3.
What are the key properties of 8-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-4H-chromeno[3,4-d][1,2]oxazole?
8-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-4H-chromeno[3,4-d][1,2]oxazole has a molecular weight of 368.41 g/mol, XLogP of 3.37, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-4H-chromeno[3,4-d][1,2]oxazole is sourced from PubChem (CID 46394778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).