1-cyclopropyl-4-(4-methoxyphenyl)sulfonyl-2,3-dihydroquinoxaline

C18H20N2O3S — CID 110715218

IUPAC1-cyclopropyl-4-(4-methoxyphenyl)sulfonyl-2,3-dihydroquinoxaline
SMILESCOc1ccc(S(=O)(=O)N2CCN(C3CC3)c3ccccc32)cc1
InChIInChI=1S/C18H20N2O3S/c1-23-15-8-10-16(11-9-15)24(21,22)20-13-12-19(14-6-7-14)17-4-2-3-5-18(17)20/h2-5,8-11,14H,6-7,12-13H2,1H3
InChIKeyGMSZAVGTGSBYBA-UHFFFAOYSA-N
MW344.44 g/mol
LogP2.87
Rot. Bonds4

About 1-cyclopropyl-4-(4-methoxyphenyl)sulfonyl-2,3-dihydroquinoxaline

1-cyclopropyl-4-(4-methoxyphenyl)sulfonyl-2,3-dihydroquinoxaline (PubChem CID 110715218) has the molecular formula C18H20N2O3S and a molecular weight of 344.44 g/mol. Its IUPAC name is 1-cyclopropyl-4-(4-methoxyphenyl)sulfonyl-2,3-dihydroquinoxaline.

Molecular Properties

Compound Name1-cyclopropyl-4-(4-methoxyphenyl)sulfonyl-2,3-dihydroquinoxaline
PubChem CID110715218
Molecular FormulaC18H20N2O3S
Molecular Weight344.44 g/mol
Exact Mass344.12
IUPAC Name1-cyclopropyl-4-(4-methoxyphenyl)sulfonyl-2,3-dihydroquinoxaline
SMILESCOc1ccc(S(=O)(=O)N2CCN(C3CC3)c3ccccc32)cc1
InChIInChI=1S/C18H20N2O3S/c1-23-15-8-10-16(11-9-15)24(21,22)20-13-12-19(14-6-7-14)17-4-2-3-5-18(17)20/h2-5,8-11,14H,6-7,12-13H2,1H3
InChIKeyGMSZAVGTGSBYBA-UHFFFAOYSA-N
XLogP2.87
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.44
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-cyclopropyl-4-(4-methoxyphenyl)sulfonyl-2,3-dihydroquinoxaline 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-cyclopropyl-4-(4-fluorophenyl)sulfonyl-2,3-dihydroquinoxaline
CID 110715217
2-(4-methoxyphenyl)sulfonyl-3,4,10,10a-tetrahydro-1H-pyrazino[1,2-a]indole
CID 110710854
8-(4-methoxyphenyl)sulfonyl-8-azabicyclo[3.2.1]octane
CID 147806045
3-methoxy-1-(4-methoxyphenyl)sulfonyl-2,3-dihydroindole
CID 132581058
1-(2-fluorophenyl)-4-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]piperazine
CID 1334438
1-(4-methoxyphenyl)sulfonyl-3,3-dimethyl-2H-indole
CID 110669474
7-(4-methoxyphenyl)sulfonyl-7-azabicyclo[4.1.0]heptane
CID 11737230
7-methoxy-1-(4-methoxyphenyl)sulfonyl-2,3-dihydroquinolin-4-one
CID 110635683
1-[4-[4-(2,3-dihydroindol-1-ylsulfonyl)phenoxy]phenyl]sulfonyl-2,3-dihydroindole
CID 91670097
1-cyclopropyl-4-[(4-methylphenyl)methylsulfonyl]-2,3-dihydroquinoxaline
CID 110715223
4-(2-chlorophenyl)-1-(4-methoxyphenyl)sulfonylpiperidine
CID 171678470
(2S)-4-(4-methoxyphenyl)sulfonyl-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide
CID 26008329

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-4-(4-methoxyphenyl)sulfonyl-2,3-dihydroquinoxaline?
The IUPAC name of 1-cyclopropyl-4-(4-methoxyphenyl)sulfonyl-2,3-dihydroquinoxaline (CID 110715218) is 1-cyclopropyl-4-(4-methoxyphenyl)sulfonyl-2,3-dihydroquinoxaline.
What is the SMILES notation for 1-cyclopropyl-4-(4-methoxyphenyl)sulfonyl-2,3-dihydroquinoxaline?
The canonical SMILES for 1-cyclopropyl-4-(4-methoxyphenyl)sulfonyl-2,3-dihydroquinoxaline is COc1ccc(S(=O)(=O)N2CCN(C3CC3)c3ccccc32)cc1.
What is the InChIKey of 1-cyclopropyl-4-(4-methoxyphenyl)sulfonyl-2,3-dihydroquinoxaline?
The InChIKey is GMSZAVGTGSBYBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3S/c1-23-15-8-10-16(11-9-15)24(21,22)20-13-12-19(14-6-7-14)17-4-2-3-5-18(17)20/h2-5,8-11,14H,6-7,12-13H2,1H3.
What are the key properties of 1-cyclopropyl-4-(4-methoxyphenyl)sulfonyl-2,3-dihydroquinoxaline?
1-cyclopropyl-4-(4-methoxyphenyl)sulfonyl-2,3-dihydroquinoxaline has a molecular weight of 344.44 g/mol, XLogP of 2.87, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-4-(4-methoxyphenyl)sulfonyl-2,3-dihydroquinoxaline is sourced from PubChem (CID 110715218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).